[1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-(4-fluorophenyl)-7,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-(4-fluorophenyl)-7,8-dimethyl-quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl] 6-bromo-2-(4-fluorophenyl)-7,8-dimethyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-fluorophenyl)-7,8-dimethyl-4-quinolinecarboxylic acid [1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methoxyphenyl)-1-oxopropan-2-yl] 6-bromo-2-(4-fluorophenyl)-7,8-dimethylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-fluorophenyl)-7,8-dimethyl-cinchoninic acid [2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl] ester Formula: C28H23BrFNO4 MolecularWeight: 536.388923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=NC2=C1C)C3=CC=C(C=C3)F)C(=O)OC(C)C(=O)C4=CC=C(C=C4)OC)Br

Isomeric SMILES

CC1=C(C=C2C(=CC(=NC2=C1C)C3=CC=C(C=C3)F)C(=O)OC(C)C(=O)C4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C28H23BrFNO4/c1-15-16(2)26-22(13-24(15)29)23(14-25(31-26)18-5-9-20(30)10-6-18)28(33)35-17(3)27(32)19-7-11-21(34-4)12-8-19/h5-14,17H,1-4H3