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

Systemtic Name: (2R,3S)-2-(4-methoxyphenyl)-6-oxidanylidene-1-(phenylmethyl)piperidine-3-carboxylic acid Openeye Name: (2R,3S)-1-benzyl-2-(4-methoxyphenyl)-6-oxo-piperidine-3-carboxylic acid CAS Name: (2R,3S)-2-(4-methoxyphenyl)-6-oxo-1-(phenylmethyl)-3-piperidinecarboxylic acid IUPAC Name: (2R,3S)-1-benzyl-2-(4-methoxyphenyl)-6-oxopiperidine-3-carboxylic acid Traditional Name: (2R,3S)-1-benzyl-6-keto-2-(4-methoxyphenyl)nipecotic acid Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(CCC(=O)N2CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2[C@H](CCC(=O)N2CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H21NO4/c1-25-16-9-7-15(8-10-16)19-17(20(23)24)11-12-18(22)21(19)13-14-5-3-2-4-6-14/h2-10,17,19H,11-13H2,1H3,(H,23,24)/t17-,19-/m0/s1