ethanedioic acid; (2-methoxyphenyl)-[4-[(2-methylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: ethanedioic acid; (2-methoxyphenyl)-[4-[(2-methylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (2-methoxyphenyl)-[4-(o-tolylmethyl)piperazin-1-yl]methanone; oxalic acid CAS Name: (2-methoxyphenyl)-[4-[(2-methylphenyl)methyl]-1-piperazinyl]methanone; oxalic acid IUPAC Name: (2-methoxyphenyl)-[4-[(2-methylphenyl)methyl]piperazin-1-yl]methanone; oxalic acid Traditional Name: (2-methoxyphenyl)-[4-(2-methylbenzyl)piperazino]methanone; oxalic acid Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC=CC=C3OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC=CC=C3OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H24N2O2.C2H2O4/c1-16-7-3-4-8-17(16)15-21-11-13-22(14-12-21)20(23)18-9-5-6-10-19(18)24-2;3-1(4)2(5)6/h3-10H,11-15H2,1-2H3;(H,3,4)(H,5,6)