[2-[4-(furan-2-ylcarbonyloxy)phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-(furan-2-ylcarbonyloxy)phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[4-(furan-2-carbonyloxy)phenyl]-2-oxo-ethyl] 6-bromo-7-chloro-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-7-chloro-3,8-dimethyl-2-phenyl-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-3,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-7-chloro-3,8-dimethyl-2-phenyl-cinchoninic acid [2-[4-(2-furoyloxy)phenyl]-2-keto-ethyl] ester Formula: C31H21BrClNO6 MolecularWeight: 618.85854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C(=C2N=C1C3=CC=CC=C3)C)Cl)Br)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CO5

Isomeric SMILES

CC1=C(C2=CC(=C(C(=C2N=C1C3=CC=CC=C3)C)Cl)Br)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CO5

InChI

InChI=1S/C31H21BrClNO6/c1-17-26(22-15-23(32)27(33)18(2)29(22)34-28(17)20-7-4-3-5-8-20)31(37)39-16-24(35)19-10-12-21(13-11-19)40-30(36)25-9-6-14-38-25/h3-15H,16H2,1-2H3