cycloheptyl (4S)-4-[2,3-bis(fluoranyl)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: cycloheptyl (4S)-4-[2,3-bis(fluoranyl)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: cycloheptyl (4S)-4-(2,3-difluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: (4S)-4-(2,3-difluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid cycloheptyl ester IUPAC Name: cycloheptyl (4S)-4-(2,3-difluorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: (4S)-4-(2,3-difluorophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyridine-5-carboxylic acid cycloheptyl ester Formula: C20H23F2NO3 MolecularWeight: 363.398326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1)C2=C(C(=CC=C2)F)F)C(=O)OC3CCCCCC3

Isomeric SMILES

CC1=C([C@H](CC(=O)N1)C2=C(C(=CC=C2)F)F)C(=O)OC3CCCCCC3

InChI

InChI=1S/C20H23F2NO3/c1-12-18(20(25)26-13-7-4-2-3-5-8-13)15(11-17(24)23-12)14-9-6-10-16(21)19(14)22/h6,9-10,13,15H,2-5,7-8,11H2,1H3,(H,23,24)/t15-/m1/s1