(3S)-1-[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid Openeye Name: (3S)-1-[2-(2-methoxyphenyl)-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: (3S)-1-[2-(2-methoxyphenyl)-2-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-[2-(2-methoxyphenyl)-2-oxoethyl]piperidine-3-carboxylic acid Traditional Name: (3S)-1-[2-keto-2-(2-methoxyphenyl)ethyl]nipecotic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)CN2CCCC(C2)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1C(=O)CN2CCC[C@@H](C2)C(=O)O

InChI

InChI=1S/C15H19NO4/c1-20-14-7-3-2-6-12(14)13(17)10-16-8-4-5-11(9-16)15(18)19/h2-3,6-7,11H,4-5,8-10H2,1H3,(H,18,19)/t11-/m0/s1