ethanedioic acid; 1-(3-methylcyclohexyl)-4-[(2-methylphenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-(3-methylcyclohexyl)-4-[(2-methylphenyl)methyl]piperazine Openeye Name: 1-(3-methylcyclohexyl)-4-(o-tolylmethyl)piperazine; oxalic acid CAS Name: 1-(3-methylcyclohexyl)-4-[(2-methylphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-(3-methylcyclohexyl)-4-[(2-methylphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(2-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=CC=C3C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCC(C1)N2CCN(CC2)CC3=CC=CC=C3C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H30N2.C2H2O4/c1-16-6-5-9-19(14-16)21-12-10-20(11-13-21)15-18-8-4-3-7-17(18)2;3-1(4)2(5)6/h3-4,7-8,16,19H,5-6,9-15H2,1-2H3;(H,3,4)(H,5,6)