[(2S)-1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: [(2S)-1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: [(1S)-2-(4-fluorophenyl)-1-methyl-2-oxo-ethyl] 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxylic acid [(2S)-1-(4-fluorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-fluorophenyl)-1-oxopropan-2-yl] 2-(3-chlorophenyl)-3-methylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-methyl-cinchoninic acid [(1S)-2-(4-fluorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C26H19ClFNO3 MolecularWeight: 447.885363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OC(C)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)O[C@@H](C)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H19ClFNO3/c1-15-23(26(31)32-16(2)25(30)17-10-12-20(28)13-11-17)21-8-3-4-9-22(21)29-24(15)18-6-5-7-19(27)14-18/h3-14,16H,1-2H3/t16-/m0/s1