methyl (2S)-2-[(2R)-4-oxidanylidene-2-propyl-2,3-dihydropyridin-1-yl]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(2R)-4-oxidanylidene-2-propyl-2,3-dihydropyridin-1-yl]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(2R)-4-oxo-2-propyl-2,3-dihydropyridin-1-yl]-3-phenyl-propanoate CAS Name: (2S)-2-[(2R)-4-oxo-2-propyl-2,3-dihydropyridin-1-yl]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2R)-4-oxo-2-propyl-2,3-dihydropyridin-1-yl]-3-phenylpropanoate Traditional Name: (2S)-2-[(2R)-4-keto-2-propyl-2,3-dihydropyridin-1-yl]-3-phenyl-propionic acid methyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(=O)C=CN1C(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCC[C@@H]1CC(=O)C=CN1[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H23NO3/c1-3-7-15-13-16(20)10-11-19(15)17(18(21)22-2)12-14-8-5-4-6-9-14/h4-6,8-11,15,17H,3,7,12-13H2,1-2H3/t15-,17+/m1/s1