(1-oxidanylidene-1-phenyl-propan-2-yl) 6-bromanyl-8-ethyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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