[2-oxidanylidene-2-(4-thiophen-2-ylcarbonyloxyphenyl)ethyl] 6-bromanyl-2-(2,4-dichlorophenyl)-8-ethyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-thiophen-2-ylcarbonyloxyphenyl)ethyl] 6-bromanyl-2-(2,4-dichlorophenyl)-8-ethyl-quinoline-4-carboxylate Openeye Name: [2-oxo-2-[4-(thiophene-2-carbonyloxy)phenyl]ethyl] 6-bromo-2-(2,4-dichlorophenyl)-8-ethyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(2,4-dichlorophenyl)-8-ethyl-4-quinolinecarboxylic acid [2-oxo-2-[4-[oxo(thiophen-2-yl)methoxy]phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(thiophene-2-carbonyloxy)phenyl]ethyl] 6-bromo-2-(2,4-dichlorophenyl)-8-ethylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(2,4-dichlorophenyl)-8-ethyl-cinchoninic acid [2-keto-2-[4-(2-thenoyloxy)phenyl]ethyl] ester Formula: C31H20BrCl2NO5S MolecularWeight: 669.3692

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CS5

Isomeric SMILES

CCC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CS5

InChI

InChI=1S/C31H20BrCl2NO5S/c1-2-17-12-19(32)13-23-24(15-26(35-29(17)23)22-10-7-20(33)14-25(22)34)30(37)39-16-27(36)18-5-8-21(9-6-18)40-31(38)28-4-3-11-41-28/h3-15H,2,16H2,1H3