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: HSQGMTRYSIHDAC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
73739

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7-/m0/s1
C9H18N2O3202.250874742272
227625

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)
C9H18N2O3202.2508565983
5360439

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7+/m1/s1
C9H18N2O3202.2508171500
5360441

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7-/m1/s1
C9H18N2O3202.25086600
5360437

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7+/m0/s1
C9H18N2O3202.25085400
71328139

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7?/m0/s1
C9H18N2O3202.25083200
17346890

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6?,7-/m1/s1
C9H18N2O3202.25082200
39064524

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)/t6-,7?/m1/s1
C9H18N2O3202.25082200

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