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 10 results

Search term: BBZPJHFECDCNGT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
22886594

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15-,16?/m1/s1
C17H22O2258.355411700
13085331

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15-,16-/m0/s1
C17H22O2258.35547700
2969570

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3
C17H22O2258.355386300
5024804

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15+,16-/m1/s1
C17H22O2258.35542100
23245537

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15-,16+/m1/s1
C17H22O2258.35542200
808667

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15+,16+/m1/s1
C17H22O2258.35542100
34890705

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13?,15?,16-/m0/s1
C17H22O2258.35541100
64863610

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15?,16?/m1/s1
C17H22O2258.35541100
95504607

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15-,16?/m0/s1
C17H22O2258.35541100
17460479

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C17H22O2/c1-11-4-7-13-10-15(11)16(19-17(13,2)3)12-5-8-14(18)9-6-12/h4-6,8-9,13,15-16,18H,7,10H2,1-3H3/t13-,15+,16?/m1/s1
C17H22O2258.35541100

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