N-[(3,4-dimethoxyphenyl)methyl]-2-(4-pyridin-2-ylpiperazin-1-yl)ethanamide; ethanedioic acid

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-pyridin-2-ylpiperazin-1-yl)ethanamide; ethanedioic acid Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(2-pyridyl)piperazin-1-yl]acetamide; oxalic acid CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(2-pyridinyl)-1-piperazinyl]acetamide; oxalic acid IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide; oxalic acid Traditional Name: oxalic acid; 2-[4-(2-pyridyl)piperazino]-N-veratryl-acetamide Formula: C22H28N4O7 MolecularWeight: 460.48032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CN2CCN(CC2)C3=CC=CC=N3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CN2CCN(CC2)C3=CC=CC=N3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N4O3.C2H2O4/c1-26-17-7-6-16(13-18(17)27-2)14-22-20(25)15-23-9-11-24(12-10-23)19-5-3-4-8-21-19;3-1(4)2(5)6/h3-8,13H,9-12,14-15H2,1-2H3,(H,22,25);(H,3,4)(H,5,6)