1-[(2-chlorophenyl)methyl]-4-(3-phenylpropyl)piperazine; ethanedioic acid

Systemtic Name: 1-[(2-chlorophenyl)methyl]-4-(3-phenylpropyl)piperazine; ethanedioic acid Openeye Name: 1-[(2-chlorophenyl)methyl]-4-(3-phenylpropyl)piperazine; oxalic acid CAS Name: 1-[(2-chlorophenyl)methyl]-4-(3-phenylpropyl)piperazine; oxalic acid IUPAC Name: 1-[(2-chlorophenyl)methyl]-4-(3-phenylpropyl)piperazine; oxalic acid Traditional Name: 1-(2-chlorobenzyl)-4-(3-phenylpropyl)piperazine; oxalic acid Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25ClN2.C2H2O4/c21-20-11-5-4-10-19(20)17-23-15-13-22(14-16-23)12-6-9-18-7-2-1-3-8-18;3-1(4)2(5)6/h1-5,7-8,10-11H,6,9,12-17H2;(H,3,4)(H,5,6)