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 7 results

Search term: JHKXZYLNVJRAAJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5373160

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N2O3S/c1-5(8(12)13)10-7(11)6(9)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,6-/m0/s1
C8H16N2O3S220.2892303300
14625127

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C8H16N2O3S/c1-5(8(12)13)10-7(11)6(9)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)
C8H16N2O3S220.2892232016221
39064559

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N2O3S/c1-5(8(12)13)10-7(11)6(9)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,6+/m1/s1
C8H16N2O3S220.28922200
50658468

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N2O3S/c1-5(8(12)13)10-7(11)6(9)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,6+/m0/s1
C8H16N2O3S220.28922100
50658681

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C8H16N2O3S/c1-5(8(12)13)10-7(11)6(9)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,6-/m1/s1
C8H16N2O3S220.28921200
120947568

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C8H16N2O3S/c1-5(8(12)13)10-7(11)6(9)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,6?/m0/s1
C8H16N2O3S220.28921100
50658397

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C8H16N2O3S/c1-5(8(12)13)10-7(11)6(9)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5?,6-/m1/s1
C8H16N2O3S220.28921100

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