methyl 1-phenyl-4-[4-(phenylmethyl)piperazin-1-yl]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-phenyl-4-[4-(phenylmethyl)piperazin-1-yl]cyclohexane-1-carboxylate Openeye Name: methyl 4-(4-benzylpiperazin-1-yl)-1-phenyl-cyclohexanecarboxylate CAS Name: 1-phenyl-4-[4-(phenylmethyl)-1-piperazinyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-benzylpiperazin-1-yl)-1-phenylcyclohexane-1-carboxylate Traditional Name: 4-(4-benzylpiperazino)-1-phenyl-cyclohexanecarboxylic acid methyl ester Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCC(CC1)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1(CCC(CC1)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N2O2/c1-29-24(28)25(22-10-6-3-7-11-22)14-12-23(13-15-25)27-18-16-26(17-19-27)20-21-8-4-2-5-9-21/h2-11,23H,12-20H2,1H3