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 5 results

Search term: QXWYBPQLLVWQGI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2232525

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H26ClNO3/c1-5-13(10-19)18-9-12-7-15(20-6-2)16(8-14(12)17)21-11(3)4/h7-8,11,13,18-19H,5-6,9-10H2,1-4H3
C16H26ClNO3315.8355413800
842746

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H26ClNO3/c1-5-13(10-19)18-9-12-7-15(20-6-2)16(8-14(12)17)21-11(3)4/h7-8,11,13,18-19H,5-6,9-10H2,1-4H3/t13-/m0/s1
C16H26ClNO3315.83552100
842747

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H26ClNO3/c1-5-13(10-19)18-9-12-7-15(20-6-2)16(8-14(12)17)21-11(3)4/h7-8,11,13,18-19H,5-6,9-10H2,1-4H3/t13-/m1/s1
C16H26ClNO3315.83552100
5798244

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H26ClNO3/c1-5-13(10-19)18-9-12-7-15(20-6-2)16(8-14(12)17)21-11(3)4/h7-8,11,13,18-19H,5-6,9-10H2,1-4H3/p+1/t13-/m0/s1
C16H27ClNO3316.84291100
5798245

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H26ClNO3/c1-5-13(10-19)18-9-12-7-15(20-6-2)16(8-14(12)17)21-11(3)4/h7-8,11,13,18-19H,5-6,9-10H2,1-4H3/p+1/t13-/m1/s1
C16H27ClNO3316.84291100

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