[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-8-ethyl-2-(3-methoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-8-ethyl-2-(3-methoxyphenyl)quinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 6-bromo-8-ethyl-2-(3-methoxyphenyl)quinoline-4-carboxylate CAS Name: 6-bromo-8-ethyl-2-(3-methoxyphenyl)-4-quinolinecarboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 6-bromo-8-ethyl-2-(3-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-8-ethyl-2-(3-methoxyphenyl)cinchoninic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C29H26BrNO4 MolecularWeight: 532.42504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)OC(C)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)OC(C)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H26BrNO4/c1-5-19-13-22(30)15-24-25(16-26(31-27(19)24)21-7-6-8-23(14-21)34-4)29(33)35-18(3)28(32)20-11-9-17(2)10-12-20/h6-16,18H,5H2,1-4H3