ethyl (3S)-1-[(6-methylpyridin-2-yl)methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[(6-methylpyridin-2-yl)methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[(6-methyl-2-pyridyl)methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(6-methyl-2-pyridinyl)methyl]-3-(2-phenoxyethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(6-methylpyridin-2-yl)methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate Traditional Name: (3S)-1-[(6-methyl-2-pyridyl)methyl]-3-(2-phenoxyethyl)nipecotic acid ethyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=CC=CC(=N2)C)CCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)CC2=CC=CC(=N2)C)CCOC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O3/c1-3-27-22(26)23(14-16-28-21-11-5-4-6-12-21)13-8-15-25(18-23)17-20-10-7-9-19(2)24-20/h4-7,9-12H,3,8,13-18H2,1-2H3/t23-/m0/s1