N-[(3,4-dimethoxyphenyl)methyl]-4-oxidanyl-2-(4-phenylpiperazin-1-yl)butanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-oxidanyl-2-(4-phenylpiperazin-1-yl)butanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-(4-phenylpiperazin-1-yl)butanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-(4-phenyl-1-piperazinyl)butanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-(4-phenylpiperazin-1-yl)butanamide Traditional Name: 4-hydroxy-2-(4-phenylpiperazino)-N-veratryl-butyramide Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C(CCO)N2CCN(CC2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C(CCO)N2CCN(CC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H31N3O4/c1-29-21-9-8-18(16-22(21)30-2)17-24-23(28)20(10-15-27)26-13-11-25(12-14-26)19-6-4-3-5-7-19/h3-9,16,20,27H,10-15,17H2,1-2H3,(H,24,28)