propyl (4S,4aR)-4-(3-fluorophenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: propyl (4S,4aR)-4-(3-fluorophenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: propyl (4S,4aR)-4-(3-fluorophenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4S,4aR)-4-(3-fluorophenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid propyl ester IUPAC Name: propyl (4S,4aR)-4-(3-fluorophenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4S,4aR)-4-(3-fluorophenyl)-5-keto-2-methyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid propyl ester Formula: C20H22FNO3 MolecularWeight: 343.391983

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(N=C2CCCC(=O)C2C1C3=CC(=CC=C3)F)C

Isomeric SMILES

CCCOC(=O)C1=C(N=C2CCCC(=O)[C@@H]2[C@H]1C3=CC(=CC=C3)F)C

InChI

InChI=1S/C20H22FNO3/c1-3-10-25-20(24)17-12(2)22-15-8-5-9-16(23)19(15)18(17)13-6-4-7-14(21)11-13/h4,6-7,11,18-19H,3,5,8-10H2,1-2H3/t18-,19+/m0/s1