(2S,3S)-2-(3-chlorophenyl)-1-ethyl-6-oxidanylidene-piperidine-3-carboxylic acid

Systemtic Name: (2S,3S)-2-(3-chlorophenyl)-1-ethyl-6-oxidanylidene-piperidine-3-carboxylic acid Openeye Name: (2S,3S)-2-(3-chlorophenyl)-1-ethyl-6-oxo-piperidine-3-carboxylic acid CAS Name: (2S,3S)-2-(3-chlorophenyl)-1-ethyl-6-oxo-3-piperidinecarboxylic acid IUPAC Name: (2S,3S)-2-(3-chlorophenyl)-1-ethyl-6-oxopiperidine-3-carboxylic acid Traditional Name: (2S,3S)-2-(3-chlorophenyl)-1-ethyl-6-keto-nipecotic acid Formula: C14H16ClNO3 MolecularWeight: 281.73474

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(CCC1=O)C(=O)O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCN1[C@@H]([C@H](CCC1=O)C(=O)O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H16ClNO3/c1-2-16-12(17)7-6-11(14(18)19)13(16)9-4-3-5-10(15)8-9/h3-5,8,11,13H,2,6-7H2,1H3,(H,18,19)/t11-,13+/m0/s1