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 5 results

Search term: WFECOQFZFNUSCB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2253927

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H29N3O/c1-3-22-10-12-23(13-11-22)15-21(25)24-19-7-5-4-6-17(19)18-14-16(2)8-9-20(18)24/h4-7,16H,3,8-15H2,1-2H3
C21H29N3O339.47446181400
1056196

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O/c1-3-22-10-12-23(13-11-22)15-21(25)24-19-7-5-4-6-17(19)18-14-16(2)8-9-20(18)24/h4-7,16H,3,8-15H2,1-2H3/t16-/m1/s1
C21H29N3O339.47452100
1056198

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O/c1-3-22-10-12-23(13-11-22)15-21(25)24-19-7-5-4-6-17(19)18-14-16(2)8-9-20(18)24/h4-7,16H,3,8-15H2,1-2H3/t16-/m0/s1
C21H29N3O339.47452100
5348315

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O/c1-3-22-10-12-23(13-11-22)15-21(25)24-19-7-5-4-6-17(19)18-14-16(2)8-9-20(18)24/h4-7,16H,3,8-15H2,1-2H3/p+2/t16-/m1/s1
C21H31N3O341.48921100
5348316

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H29N3O/c1-3-22-10-12-23(13-11-22)15-21(25)24-19-7-5-4-6-17(19)18-14-16(2)8-9-20(18)24/h4-7,16H,3,8-15H2,1-2H3/p+2/t16-/m0/s1
C21H31N3O341.48921100

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