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

Systemtic Name: 3-[1-[1-[3,4-bis(oxidanyl)phenyl]-1-oxidanylidene-propan-2-yl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-(3,4-dihydroxyphenyl)-1-methyl-2-oxo-ethyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[1-(3,4-dihydroxyphenyl)-1-oxopropan-2-yl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[1-(3,4-dihydroxyphenyl)-1-oxopropan-2-yl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-(3,4-dihydroxyphenyl)-2-keto-1-methyl-ethyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=C(C=C1)O)O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC(C(=O)C1=CC(=C(C=C1)O)O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H23N3O4/c1-13(20(27)14-6-7-18(25)19(26)12-14)23-10-8-15(9-11-23)24-17-5-3-2-4-16(17)22-21(24)28/h2-7,12-13,15,25-26H,8-11H2,1H3,(H,22,28)