1-(2-cyclohexyl-2-oxidanylidene-ethanoyl)-4-[1-(4-methoxyphenyl)butyl]piperidine-2-carboxylic acid

Systemtic Name: 1-(2-cyclohexyl-2-oxidanylidene-ethanoyl)-4-[1-(4-methoxyphenyl)butyl]piperidine-2-carboxylic acid Openeye Name: 1-(2-cyclohexyl-2-oxo-acetyl)-4-[1-(4-methoxyphenyl)butyl]piperidine-2-carboxylic acid CAS Name: 1-(2-cyclohexyl-1,2-dioxoethyl)-4-[1-(4-methoxyphenyl)butyl]-2-piperidinecarboxylic acid IUPAC Name: 1-(2-cyclohexyl-2-oxoacetyl)-4-[1-(4-methoxyphenyl)butyl]piperidine-2-carboxylic acid Traditional Name: 1-(2-cyclohexyl-2-keto-acetyl)-4-[1-(4-methoxyphenyl)butyl]pipecolinic acid Formula: C25H35NO5 MolecularWeight: 429.5491

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCN(C(C1)C(=O)O)C(=O)C(=O)C2CCCCC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC(C1CCN(C(C1)C(=O)O)C(=O)C(=O)C2CCCCC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H35NO5/c1-3-7-21(17-10-12-20(31-2)13-11-17)19-14-15-26(22(16-19)25(29)30)24(28)23(27)18-8-5-4-6-9-18/h10-13,18-19,21-22H,3-9,14-16H2,1-2H3,(H,29,30)