ethanedioic acid; 1-[1-(3-methylcyclohexyl)piperidin-4-yl]-4-phenyl-piperazine

Systemtic Name: ethanedioic acid; 1-[1-(3-methylcyclohexyl)piperidin-4-yl]-4-phenyl-piperazine Openeye Name: 1-[1-(3-methylcyclohexyl)-4-piperidyl]-4-phenyl-piperazine; oxalic acid CAS Name: 1-[1-(3-methylcyclohexyl)-4-piperidinyl]-4-phenylpiperazine; oxalic acid IUPAC Name: 1-[1-(3-methylcyclohexyl)piperidin-4-yl]-4-phenylpiperazine; oxalic acid Traditional Name: 1-[1-(3-methylcyclohexyl)-4-piperidyl]-4-phenyl-piperazine; oxalic acid Formula: C24H37N3O4 MolecularWeight: 431.56828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCC(C1)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H35N3.C2H2O4/c1-19-6-5-9-22(18-19)23-12-10-21(11-13-23)25-16-14-24(15-17-25)20-7-3-2-4-8-20;3-1(4)2(5)6/h2-4,7-8,19,21-22H,5-6,9-18H2,1H3;(H,3,4)(H,5,6)