ethyl (4R,4aS)-4-(4-fluorophenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: ethyl (4R,4aS)-4-(4-fluorophenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: ethyl (4R,4aS)-4-(4-fluorophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4R,4aS)-4-(4-fluorophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R,4aS)-4-(4-fluorophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4R,4aS)-4-(4-fluorophenyl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid ethyl ester Formula: C19H20FNO3 MolecularWeight: 329.365403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2C(=O)CCC=C2N=C1C)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1[C@@H]([C@@H]2C(=O)CCC=C2N=C1C)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H20FNO3/c1-3-24-19(23)16-11(2)21-14-5-4-6-15(22)18(14)17(16)12-7-9-13(20)10-8-12/h5,7-10,16-18H,3-4,6H2,1-2H3/t16?,17-,18-/m0/s1