ethyl (3R,4R)-3-(2-ethoxy-2-oxidanylidene-ethyl)-1-(4-methoxyphenyl)piperidine-4-carboxylate

Systemtic Name: ethyl (3R,4R)-3-(2-ethoxy-2-oxidanylidene-ethyl)-1-(4-methoxyphenyl)piperidine-4-carboxylate Openeye Name: ethyl (3R,4R)-3-(2-ethoxy-2-oxo-ethyl)-1-(4-methoxyphenyl)piperidine-4-carboxylate CAS Name: (3R,4R)-3-(2-ethoxy-2-oxoethyl)-1-(4-methoxyphenyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4R)-3-(2-ethoxy-2-oxoethyl)-1-(4-methoxyphenyl)piperidine-4-carboxylate Traditional Name: (3R,4R)-3-(2-ethoxy-2-keto-ethyl)-1-(4-methoxyphenyl)isonipecotic acid ethyl ester Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(CCC1C(=O)OCC)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C[C@H]1CN(CC[C@H]1C(=O)OCC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H27NO5/c1-4-24-18(21)12-14-13-20(11-10-17(14)19(22)25-5-2)15-6-8-16(23-3)9-7-15/h6-9,14,17H,4-5,10-13H2,1-3H3/t14-,17+/m0/s1