1-[(2,4-dimethoxyphenyl)methyl]-4-(phenylmethyl)piperazine; ethanedioic acid

Systemtic Name: 1-[(2,4-dimethoxyphenyl)methyl]-4-(phenylmethyl)piperazine; ethanedioic acid Openeye Name: 1-benzyl-4-[(2,4-dimethoxyphenyl)methyl]piperazine; oxalic acid CAS Name: 1-[(2,4-dimethoxyphenyl)methyl]-4-(phenylmethyl)piperazine; oxalic acid IUPAC Name: 1-benzyl-4-[(2,4-dimethoxyphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-benzyl-4-(2,4-dimethoxybenzyl)piperazine; oxalic acid Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCN(CC2)CC3=CC=CC=C3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCN(CC2)CC3=CC=CC=C3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N2O2.C2H2O4/c1-23-19-9-8-18(20(14-19)24-2)16-22-12-10-21(11-13-22)15-17-6-4-3-5-7-17;3-1(4)2(5)6/h3-9,14H,10-13,15-16H2,1-2H3;(H,3,4)(H,5,6)