N-(2-cyanophenyl)-2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]ethanamide; ethanedioic acid

Systemtic Name: N-(2-cyanophenyl)-2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]ethanamide; ethanedioic acid Openeye Name: N-(2-cyanophenyl)-2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]acetamide; oxalic acid CAS Name: N-(2-cyanophenyl)-2-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]acetamide; oxalic acid IUPAC Name: N-(2-cyanophenyl)-2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]acetamide; oxalic acid Traditional Name: N-(2-cyanophenyl)-2-(4-veratroylpiperazino)acetamide; oxalic acid Formula: C24H26N4O8 MolecularWeight: 498.48524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C#N)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C#N)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H24N4O4.C2H2O4/c1-29-19-8-7-16(13-20(19)30-2)22(28)26-11-9-25(10-12-26)15-21(27)24-18-6-4-3-5-17(18)14-23;3-1(4)2(5)6/h3-8,13H,9-12,15H2,1-2H3,(H,24,27);(H,3,4)(H,5,6)