[4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-yl]-phenyl-methanone; ethanedioic acid

Systemtic Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-yl]-phenyl-methanone; ethanedioic acid Openeye Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-yl]-phenyl-methanone; oxalic acid CAS Name: [4-[(2,4-dimethoxyphenyl)methyl]-1-piperazinyl]-phenylmethanone; oxalic acid IUPAC Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-yl]-phenylmethanone; oxalic acid Traditional Name: [4-(2,4-dimethoxybenzyl)piperazino]-phenyl-methanone; oxalic acid Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3.C2H2O4/c1-24-18-9-8-17(19(14-18)25-2)15-21-10-12-22(13-11-21)20(23)16-6-4-3-5-7-16;3-1(4)2(5)6/h3-9,14H,10-13,15H2,1-2H3;(H,3,4)(H,5,6)