[2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-(phenoxymethyl)benzoate

Systemtic Name: [2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-(phenoxymethyl)benzoate Openeye Name: [2-[(3R,5S)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl] 2-(phenoxymethyl)benzoate CAS Name: 2-(phenoxymethyl)benzoic acid [2-[(3R,5S)-3,5-dimethyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl] 2-(phenoxymethyl)benzoate Traditional Name: 2-(phenoxymethyl)benzoic acid [2-[(3R,5S)-3,5-dimethylpiperidino]-2-keto-ethyl] ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)COC(=O)C2=CC=CC=C2COC3=CC=CC=C3)C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)C(=O)COC(=O)C2=CC=CC=C2COC3=CC=CC=C3)C

InChI

InChI=1S/C23H27NO4/c1-17-12-18(2)14-24(13-17)22(25)16-28-23(26)21-11-7-6-8-19(21)15-27-20-9-4-3-5-10-20/h3-11,17-18H,12-16H2,1-2H3/t17-,18+