N-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]ethyl]pyridine-4-carboxamide

Systemtic Name: N-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]ethyl]pyridine-4-carboxamide Openeye Name: N-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethyl]pyridine-4-carboxamide CAS Name: N-[2-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]ethyl]-4-pyridinecarboxamide IUPAC Name: N-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethyl]pyridine-4-carboxamide Traditional Name: N-[2-(4-veratroylpiperazino)ethyl]isonicotinamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=NC=C3)OC

InChI

InChI=1S/C21H26N4O4/c1-28-18-4-3-17(15-19(18)29-2)21(27)25-13-11-24(12-14-25)10-9-23-20(26)16-5-7-22-8-6-16/h3-8,15H,9-14H2,1-2H3,(H,23,26)