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: JWBLQDDHSDGEGR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5374132

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)/t10-,12-,13-/m0/s1
C15H22N2O3278.3468292400
16568357

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)
C15H22N2O3278.34684418126
21107535

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)/t10?,12-,13+/m1/s1
C15H22N2O3278.34683300
39564308

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)/t10?,12-,13?/m1/s1
C15H22N2O3278.34682200
39564344

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)/t10-,12+,13-/m0/s1
C15H22N2O3278.34682200
115067825

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)/t10?,12-,13-/m0/s1
C15H22N2O3278.34681100
115067882

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)/t10?,12?,13-/m0/s1
C15H22N2O3278.34681100
115068245

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)/t10-,12?,13-/m0/s1
C15H22N2O3278.34681100

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