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

Systemtic Name: (2S,3R)-2-(3-chlorophenyl)-6-oxidanylidene-1-propyl-piperidine-3-carboxylic acid Openeye Name: (2S,3R)-2-(3-chlorophenyl)-6-oxo-1-propyl-piperidine-3-carboxylic acid CAS Name: (2S,3R)-2-(3-chlorophenyl)-6-oxo-1-propyl-3-piperidinecarboxylic acid IUPAC Name: (2S,3R)-2-(3-chlorophenyl)-6-oxo-1-propylpiperidine-3-carboxylic acid Traditional Name: (2S,3R)-2-(3-chlorophenyl)-6-keto-1-propyl-nipecotic acid Formula: C15H18ClNO3 MolecularWeight: 295.76132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(CCC1=O)C(=O)O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCN1[C@@H]([C@@H](CCC1=O)C(=O)O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H18ClNO3/c1-2-8-17-13(18)7-6-12(15(19)20)14(17)10-4-3-5-11(16)9-10/h3-5,9,12,14H,2,6-8H2,1H3,(H,19,20)/t12-,14-/m1/s1