(2R,3S)-1-ethyl-2-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylic acid

Systemtic Name: (2R,3S)-1-ethyl-2-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylic acid Openeye Name: (2R,3S)-1-ethyl-2-(4-methoxyphenyl)-6-oxo-piperidine-3-carboxylic acid CAS Name: (2R,3S)-1-ethyl-2-(4-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid IUPAC Name: (2R,3S)-1-ethyl-2-(4-methoxyphenyl)-6-oxopiperidine-3-carboxylic acid Traditional Name: (2R,3S)-1-ethyl-6-keto-2-(4-methoxyphenyl)nipecotic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO4/c1-3-16-13(17)9-8-12(15(18)19)14(16)10-4-6-11(20-2)7-5-10/h4-7,12,14H,3,8-9H2,1-2H3,(H,18,19)/t12-,14-/m0/s1