3-[1-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-(3,4-dihydroxyphenyl)-2-keto-ethyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(=O)C4=CC(=C(C=C4)O)O

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC(=O)C4=CC(=C(C=C4)O)O

InChI

InChI=1S/C20H21N3O4/c24-17-6-5-13(11-18(17)25)19(26)12-22-9-7-14(8-10-22)23-16-4-2-1-3-15(16)21-20(23)27/h1-6,11,14,24-25H,7-10,12H2,(H,21,27)