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

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 6-bromanyl-8-methyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 6-bromo-8-methyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 6-bromo-8-methyl-2-thiophen-2-yl-4-quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 6-bromo-8-methyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 6-bromo-8-methyl-2-(2-thienyl)cinchoninic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C24H18BrNO3S MolecularWeight: 480.37362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)OC(C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)OC(C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H18BrNO3S/c1-14-11-17(25)12-18-19(13-20(26-22(14)18)21-9-6-10-30-21)24(28)29-15(2)23(27)16-7-4-3-5-8-16/h3-13,15H,1-2H3