ethanedioic acid; 1-(4-methylcyclohexyl)-4-[1-(phenylmethyl)piperidin-4-yl]piperazine

Systemtic Name: ethanedioic acid; 1-(4-methylcyclohexyl)-4-[1-(phenylmethyl)piperidin-4-yl]piperazine Openeye Name: 1-(1-benzyl-4-piperidyl)-4-(4-methylcyclohexyl)piperazine; oxalic acid CAS Name: 1-(4-methylcyclohexyl)-4-[1-(phenylmethyl)-4-piperidinyl]piperazine; oxalic acid IUPAC Name: 1-(1-benzylpiperidin-4-yl)-4-(4-methylcyclohexyl)piperazine; oxalic acid Traditional Name: 1-(1-benzyl-4-piperidyl)-4-(4-methylcyclohexyl)piperazine; oxalic acid Formula: C25H39N3O4 MolecularWeight: 445.59486

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N2CCN(CC2)C3CCN(CC3)CC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCC(CC1)N2CCN(CC2)C3CCN(CC3)CC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H37N3.C2H2O4/c1-20-7-9-22(10-8-20)25-15-17-26(18-16-25)23-11-13-24(14-12-23)19-21-5-3-2-4-6-21;3-1(4)2(5)6/h2-6,20,22-23H,7-19H2,1H3;(H,3,4)(H,5,6)