ethyl (2R,3S)-3-methyl-4-oxidanylidene-2-piperidin-1-yl-4-pyridin-4-yl-butanoate

Systemtic Name: ethyl (2R,3S)-3-methyl-4-oxidanylidene-2-piperidin-1-yl-4-pyridin-4-yl-butanoate Openeye Name: ethyl (2R,3S)-3-methyl-4-oxo-2-(1-piperidyl)-4-(4-pyridyl)butanoate CAS Name: (2R,3S)-3-methyl-4-oxo-2-(1-piperidinyl)-4-pyridin-4-ylbutanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-3-methyl-4-oxo-2-piperidin-1-yl-4-pyridin-4-ylbutanoate Traditional Name: (2R,3S)-4-keto-3-methyl-2-piperidino-4-(4-pyridyl)butyric acid ethyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C(=O)C1=CC=NC=C1)N2CCCCC2

Isomeric SMILES

CCOC(=O)[C@@H]([C@H](C)C(=O)C1=CC=NC=C1)N2CCCCC2

InChI

InChI=1S/C17H24N2O3/c1-3-22-17(21)15(19-11-5-4-6-12-19)13(2)16(20)14-7-9-18-10-8-14/h7-10,13,15H,3-6,11-12H2,1-2H3/t13-,15+/m0/s1