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

Systemtic Name: ethanedioic acid; 1-[(4-ethylphenyl)methyl]-4-(3-methylcyclohexyl)piperazine Openeye Name: 1-[(4-ethylphenyl)methyl]-4-(3-methylcyclohexyl)piperazine; oxalic acid CAS Name: 1-[(4-ethylphenyl)methyl]-4-(3-methylcyclohexyl)piperazine; oxalic acid IUPAC Name: 1-[(4-ethylphenyl)methyl]-4-(3-methylcyclohexyl)piperazine; oxalic acid Traditional Name: 1-(4-ethylbenzyl)-4-(3-methylcyclohexyl)piperazine; oxalic acid Formula: C22H34N2O4 MolecularWeight: 390.51636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)C3CCCC(C3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)C3CCCC(C3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H32N2.C2H2O4/c1-3-18-7-9-19(10-8-18)16-21-11-13-22(14-12-21)20-6-4-5-17(2)15-20;3-1(4)2(5)6/h7-10,17,20H,3-6,11-16H2,1-2H3;(H,3,4)(H,5,6)