2-(3-chlorophenyl)-1-methyl-6-oxidanylidene-piperidine-3-carboxylic acid

Systemtic Name: 2-(3-chlorophenyl)-1-methyl-6-oxidanylidene-piperidine-3-carboxylic acid Openeye Name: 2-(3-chlorophenyl)-1-methyl-6-oxo-piperidine-3-carboxylic acid CAS Name: 2-(3-chlorophenyl)-1-methyl-6-oxo-3-piperidinecarboxylic acid IUPAC Name: 2-(3-chlorophenyl)-1-methyl-6-oxopiperidine-3-carboxylic acid Traditional Name: 2-(3-chlorophenyl)-6-keto-1-methyl-nipecotic acid Formula: C13H14ClNO3 MolecularWeight: 267.70816

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(CCC1=O)C(=O)O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CN1C(C(CCC1=O)C(=O)O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H14ClNO3/c1-15-11(16)6-5-10(13(17)18)12(15)8-3-2-4-9(14)7-8/h2-4,7,10,12H,5-6H2,1H3,(H,17,18)