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 11 results

Search term: KQBLYDZKTIEVTF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4789246

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/b13-12+
C18H18ClNOS331.8596241600
10865216

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/b13-12-
C18H18ClNOS331.85967600
3445613

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3
C18H18ClNOS331.859626200
5402162

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/t18-/m0/s1
C18H18ClNOS331.85962100
1763409

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/b13-12+/t18-/m0/s1
C18H18ClNOS331.85962100
1763405

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/b13-12-/t18-/m1/s1
C18H18ClNOS331.85962100
1763407

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/b13-12+/t18-/m1/s1
C18H18ClNOS331.85962100
1763408

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/p+1/b13-12+/t18-/m0/s1
C18H19ClNOS332.8671100
1763406

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/p+1/b13-12+/t18-/m1/s1
C18H19ClNOS332.8671100
1763404

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/p+1/b13-12-/t18-/m1/s1
C18H19ClNOS332.8671100
5402161

Charge

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18ClNOS/c1-20-18(15-8-2-3-9-16(15)19)10-4-6-13(17(18)21)12-14-7-5-11-22-14/h2-3,5,7-9,11-12,20H,4,6,10H2,1H3/p+1/t18-/m0/s1
C18H19ClNOS332.8671100

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