ethanedioic acid; 1-[(4-methoxyphenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-[(4-methoxyphenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-(m-tolylmethyl)piperazine; oxalic acid CAS Name: 1-[(4-methoxyphenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(3-methylbenzyl)-4-p-anisyl-piperazine; oxalic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CC3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CC3=CC=C(C=C3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N2O.C2H2O4/c1-17-4-3-5-19(14-17)16-22-12-10-21(11-13-22)15-18-6-8-20(23-2)9-7-18;3-1(4)2(5)6/h3-9,14H,10-13,15-16H2,1-2H3;(H,3,4)(H,5,6)