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 8 results

Search term: UVBBPRJLXWJSHK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
290132

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)
C12H16N2O2S252.3326433900
2103876

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)/t10-,11?/m0/s1
C12H16N2O2S252.33264261700
26564016

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)/t10?,11-/m1/s1
C12H16N2O2S252.33267600
589840

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)/t10-,11-/m0/s1
C12H16N2O2S252.33264200
589841

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)/t10-,11+/m0/s1
C12H16N2O2S252.33263200
589838

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)/t10-,11+/m1/s1
C12H16N2O2S252.33263200
589839

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)/t10-,11-/m1/s1
C12H16N2O2S252.33263200
23498692

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C12H16N2O2S/c1-14(2)9-5-3-8(4-6-9)11-13-10(7-17-11)12(15)16/h3-6,10-11,13H,7H2,1-2H3,(H,15,16)/t10-,11?/m1/s1
C12H16N2O2S252.33263100

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