Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 26 results

Search term: SIIICDNNMDMWCI (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10505251

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1
C16H20INO2385.243946610
8127665

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3
C16H20INO2385.24102100
97290

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1
C16H20INO2385.248800
7997016

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1/i17-4
C16H20123INO2381.33557800
8083773

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12?,13-,14?,15-/m0/s1
C16H20INO2385.245400
8515367

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1/i17-2
C16H20125INO2383.24015500
23145570

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14?,15?/m1/s1
C16H20INO2385.245500
8105444

2 of 4 defined stereocentres - 2/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12?,13-,14?,15+/m1/s1/i17-4
C16H20123INO2381.33554300
8018798

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15-/m0/s1
C16H20INO2385.243200
23135262

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13?,14?,15+/m1/s1
C16H20INO2385.243300
24683087

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14?,15+/m1/s1
C16H20INO2385.243300
32699452

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1/i17-3
C16H20124INO2382.24173500
76713471

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12?,13-,14-,15+/m1/s1
C16H20INO2385.243400
28530669

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13?,14+,15-/m0/s1
C16H20INO2385.242200
24658936

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12?,13-,14?,15+/m1/s1
C16H20INO2385.242200
8819515

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1/i2T3
C16H17T3INO2391.26432100
8244062

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15+/m0/s1/i17-2
C16H20125INO2383.24012200
396755

0 of 4 defined stereocentres - 0/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/i17-2
C16H20125INO2383.24012300
396756

0 of 4 defined stereocentres - 0/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/i17-4
C16H20123INO2381.33552300
397132

0 of 4 defined stereocentres - 0/4 defined

Non-standard isotope
InChI=1/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/i1-1
C1511CH20INO2384.24072200
12

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