1-phenyl-4-[4-(phenylmethyl)piperazin-1-yl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-phenyl-4-[4-(phenylmethyl)piperazin-1-yl]cyclohexane-1-carboxylic acid Openeye Name: 4-(4-benzylpiperazin-1-yl)-1-phenyl-cyclohexanecarboxylic acid CAS Name: 1-phenyl-4-[4-(phenylmethyl)-1-piperazinyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-(4-benzylpiperazin-1-yl)-1-phenylcyclohexane-1-carboxylic acid Traditional Name: 4-(4-benzylpiperazino)-1-phenyl-cyclohexanecarboxylic acid Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2CCN(CC2)CC3=CC=CC=C3)(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(CCC1N2CCN(CC2)CC3=CC=CC=C3)(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H30N2O2/c27-23(28)24(21-9-5-2-6-10-21)13-11-22(12-14-24)26-17-15-25(16-18-26)19-20-7-3-1-4-8-20/h1-10,22H,11-19H2,(H,27,28)