1-[2-[(4-cyclohexylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[(4-cyclohexylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(4-cyclohexylanilino)-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(4-cyclohexylanilino)-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(4-cyclohexylanilino)-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(4-cyclohexylanilino)-2-keto-ethyl]isonipecotic acid Formula: C20H28N2O3 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)NC(=O)CN3CCC(CC3)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)NC(=O)CN3CCC(CC3)C(=O)O

InChI

InChI=1S/C20H28N2O3/c23-19(14-22-12-10-17(11-13-22)20(24)25)21-18-8-6-16(7-9-18)15-4-2-1-3-5-15/h6-9,15,17H,1-5,10-14H2,(H,21,23)(H,24,25)