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

Systemtic Name: 4-[1-(4-methoxyphenyl)butyl]-1-(2-oxidanylidene-2-phenyl-ethanoyl)piperidine-2-carboxylic acid Openeye Name: 4-[1-(4-methoxyphenyl)butyl]-1-(2-oxo-2-phenyl-acetyl)piperidine-2-carboxylic acid CAS Name: 1-(1,2-dioxo-2-phenylethyl)-4-[1-(4-methoxyphenyl)butyl]-2-piperidinecarboxylic acid IUPAC Name: 4-[1-(4-methoxyphenyl)butyl]-1-(2-oxo-2-phenylacetyl)piperidine-2-carboxylic acid Traditional Name: 1-(2-keto-2-phenyl-acetyl)-4-[1-(4-methoxyphenyl)butyl]pipecolinic acid Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCN(C(C1)C(=O)O)C(=O)C(=O)C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC(C1CCN(C(C1)C(=O)O)C(=O)C(=O)C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H29NO5/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/h4-6,8-13,19,21-22H,3,7,14-16H2,1-2H3,(H,29,30)