ethanedioic acid; 1-(3-methylcyclohexyl)-4-[(4-methylphenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-(3-methylcyclohexyl)-4-[(4-methylphenyl)methyl]piperazine Openeye Name: 1-(3-methylcyclohexyl)-4-(p-tolylmethyl)piperazine; oxalic acid CAS Name: 1-(3-methylcyclohexyl)-4-[(4-methylphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-(3-methylcyclohexyl)-4-[(4-methylphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(4-methylbenzyl)-4-(3-methylcyclohexyl)piperazine; oxalic acid Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)N2CCN(CC2)CC3=CC=C(C=C3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCC(C1)N2CCN(CC2)CC3=CC=C(C=C3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H30N2.C2H2O4/c1-16-6-8-18(9-7-16)15-20-10-12-21(13-11-20)19-5-3-4-17(2)14-19;3-1(4)2(5)6/h6-9,17,19H,3-5,10-15H2,1-2H3;(H,3,4)(H,5,6)