4-(1-cyclohexylethylamino)-1-(2-phenylcyclohexyl)piperidine-4-carboxylic acid

Systemtic Name: 4-(1-cyclohexylethylamino)-1-(2-phenylcyclohexyl)piperidine-4-carboxylic acid Openeye Name: 4-(1-cyclohexylethylamino)-1-(2-phenylcyclohexyl)piperidine-4-carboxylic acid CAS Name: 4-(1-cyclohexylethylamino)-1-(2-phenylcyclohexyl)-4-piperidinecarboxylic acid IUPAC Name: 4-(1-cyclohexylethylamino)-1-(2-phenylcyclohexyl)piperidine-4-carboxylic acid Traditional Name: 4-(1-cyclohexylethylamino)-1-(2-phenylcyclohexyl)isonipecotic acid Formula: C26H40N2O2 MolecularWeight: 412.608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC2(CCN(CC2)C3CCCCC3C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C1CCCCC1)NC2(CCN(CC2)C3CCCCC3C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H40N2O2/c1-20(21-10-4-2-5-11-21)27-26(25(29)30)16-18-28(19-17-26)24-15-9-8-14-23(24)22-12-6-3-7-13-22/h3,6-7,12-13,20-21,23-24,27H,2,4-5,8-11,14-19H2,1H3,(H,29,30)