ethyl (3R)-3-methyl-1-[[(3R,4R)-2-oxidanylidene-3-phenyl-oxan-4-yl]methyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-methyl-1-[[(3R,4R)-2-oxidanylidene-3-phenyl-oxan-4-yl]methyl]piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-methyl-1-[[(3R,4R)-2-oxo-3-phenyl-tetrahydropyran-4-yl]methyl]piperidine-3-carboxylate CAS Name: (3R)-3-methyl-1-[[(3R,4R)-2-oxo-3-phenyl-4-oxanyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-methyl-1-[[(3R,4R)-2-oxo-3-phenyloxan-4-yl]methyl]piperidine-3-carboxylate Traditional Name: (3R)-1-[[(3R,4R)-2-keto-3-phenyl-tetrahydropyran-4-yl]methyl]-3-methyl-nipecotic acid ethyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2CCOC(=O)C2C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)C[C@@H]2CCOC(=O)[C@H]2C3=CC=CC=C3)C

InChI

InChI=1S/C21H29NO4/c1-3-25-20(24)21(2)11-7-12-22(15-21)14-17-10-13-26-19(23)18(17)16-8-5-4-6-9-16/h4-6,8-9,17-18H,3,7,10-15H2,1-2H3/t17-,18-,21+/m0/s1