(2R,3R)-1-ethyl-2-(2-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylic acid

Systemtic Name: (2R,3R)-1-ethyl-2-(2-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylic acid Openeye Name: (2R,3R)-1-ethyl-2-(o-tolyl)-6-oxo-piperidine-3-carboxylic acid CAS Name: (2R,3R)-1-ethyl-2-(2-methylphenyl)-6-oxo-3-piperidinecarboxylic acid IUPAC Name: (2R,3R)-1-ethyl-2-(2-methylphenyl)-6-oxopiperidine-3-carboxylic acid Traditional Name: (2R,3R)-1-ethyl-6-keto-2-(o-tolyl)nipecotic acid Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(CCC1=O)C(=O)O)C2=CC=CC=C2C

Isomeric SMILES

CCN1[C@H]([C@@H](CCC1=O)C(=O)O)C2=CC=CC=C2C

InChI

InChI=1S/C15H19NO3/c1-3-16-13(17)9-8-12(15(18)19)14(16)11-7-5-4-6-10(11)2/h4-7,12,14H,3,8-9H2,1-2H3,(H,18,19)/t12-,14+/m1/s1