ethanedioic acid; 1-(4-phenylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine

Systemtic Name: ethanedioic acid; 1-(4-phenylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine Openeye Name: oxalic acid; 1-(4-phenylcyclohexyl)-4-(4-pyridylmethyl)piperazine CAS Name: oxalic acid; 1-(4-phenylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine IUPAC Name: oxalic acid; 1-(4-phenylcyclohexyl)-4-(pyridin-4-ylmethyl)piperazine Traditional Name: oxalic acid; 1-(4-phenylcyclohexyl)-4-(4-pyridylmethyl)piperazine Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)N3CCN(CC3)CC4=CC=NC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)N3CCN(CC3)CC4=CC=NC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H29N3.C2H2O4/c1-2-4-20(5-3-1)21-6-8-22(9-7-21)25-16-14-24(15-17-25)18-19-10-12-23-13-11-19;3-1(4)2(5)6/h1-5,10-13,21-22H,6-9,14-18H2;(H,3,4)(H,5,6)