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 6 results

Search term: HZTSOTGWOQPWON (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2228910

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H13N3O6S/c17-11-12(18)15-9-6-7(3-4-8(9)14-11)23(21,22)16-5-1-2-10(16)13(19)20/h3-4,6,10H,1-2,5H2,(H,14,17)(H,15,18)(H,19,20)
C13H13N3O6S339.32382232000
789879

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13N3O6S/c17-11-12(18)15-9-6-7(3-4-8(9)14-11)23(21,22)16-5-1-2-10(16)13(19)20/h3-4,6,10H,1-2,5H2,(H,14,17)(H,15,18)(H,19,20)/t10-/m0/s1
C13H13N3O6S339.32386600
789880

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13N3O6S/c17-11-12(18)15-9-6-7(3-4-8(9)14-11)23(21,22)16-5-1-2-10(16)13(19)20/h3-4,6,10H,1-2,5H2,(H,14,17)(H,15,18)(H,19,20)/t10-/m1/s1
C13H13N3O6S339.32386600
3642439

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H13N3O6S/c17-11-12(18)15-9-6-7(3-4-8(9)14-11)23(21,22)16-5-1-2-10(16)13(19)20/h3-4,6,10H,1-2,5H2,(H,14,17)(H,15,18)(H,19,20)/p-1
C13H12N3O6S338.315881100
5406328

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13N3O6S/c17-11-12(18)15-9-6-7(3-4-8(9)14-11)23(21,22)16-5-1-2-10(16)13(19)20/h3-4,6,10H,1-2,5H2,(H,14,17)(H,15,18)(H,19,20)/p-1/t10-/m1/s1
C13H12N3O6S338.31641100
5406329

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H13N3O6S/c17-11-12(18)15-9-6-7(3-4-8(9)14-11)23(21,22)16-5-1-2-10(16)13(19)20/h3-4,6,10H,1-2,5H2,(H,14,17)(H,15,18)(H,19,20)/p-1/t10-/m0/s1
C13H12N3O6S338.31641100

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