ethanedioic acid; 1-[(4-ethoxyphenyl)methyl]-4-(phenylmethyl)piperazine

Systemtic Name: ethanedioic acid; 1-[(4-ethoxyphenyl)methyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[(4-ethoxyphenyl)methyl]piperazine; oxalic acid CAS Name: 1-[(4-ethoxyphenyl)methyl]-4-(phenylmethyl)piperazine; oxalic acid IUPAC Name: 1-benzyl-4-[(4-ethoxyphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-benzyl-4-(4-ethoxybenzyl)piperazine; oxalic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCN(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCN(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

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