[2-[4-(furan-2-ylcarbonyloxy)phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-(furan-2-ylcarbonyloxy)phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: [2-[4-(furan-2-carbonyloxy)phenyl]-2-oxo-ethyl] 6-bromo-7-chloro-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 6-bromo-7-chloro-2-(4-methoxyphenyl)-8-methyl-4-quinolinecarboxylic acid [2-[4-[2-furanyl(oxo)methoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(furan-2-carbonyloxy)phenyl]-2-oxoethyl] 6-bromo-7-chloro-2-(4-methoxyphenyl)-8-methylquinoline-4-carboxylate Traditional Name: 6-bromo-7-chloro-2-(4-methoxyphenyl)-8-methyl-cinchoninic acid [2-[4-(2-furoyloxy)phenyl]-2-keto-ethyl] ester Formula: C31H21BrClNO7 MolecularWeight: 634.85794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1Cl)Br)C(=CC(=N2)C3=CC=C(C=C3)OC)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CO5

Isomeric SMILES

CC1=C2C(=CC(=C1Cl)Br)C(=CC(=N2)C3=CC=C(C=C3)OC)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CO5

InChI

InChI=1S/C31H21BrClNO7/c1-17-28(33)24(32)14-22-23(15-25(34-29(17)22)18-5-9-20(38-2)10-6-18)30(36)40-16-26(35)19-7-11-21(12-8-19)41-31(37)27-4-3-13-39-27/h3-15H,16H2,1-2H3