ethanedioic acid; 1-(3-phenylpropyl)-4-(pyridin-3-ylmethyl)piperazine

Systemtic Name: ethanedioic acid; 1-(3-phenylpropyl)-4-(pyridin-3-ylmethyl)piperazine Openeye Name: oxalic acid; 1-(3-phenylpropyl)-4-(3-pyridylmethyl)piperazine CAS Name: oxalic acid; 1-(3-phenylpropyl)-4-(3-pyridinylmethyl)piperazine IUPAC Name: oxalic acid; 1-(3-phenylpropyl)-4-(pyridin-3-ylmethyl)piperazine Traditional Name: oxalic acid; 1-(3-phenylpropyl)-4-(3-pyridylmethyl)piperazine Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CN=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CN=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H25N3.C2H2O4/c1-2-6-18(7-3-1)9-5-11-21-12-14-22(15-13-21)17-19-8-4-10-20-16-19;3-1(4)2(5)6/h1-4,6-8,10,16H,5,9,11-15,17H2;(H,3,4)(H,5,6)