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

Systemtic Name: [2-[4-(furan-2-ylcarbonyloxy)phenyl]-2-oxidanylidene-ethyl] 7-chloranyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[4-(furan-2-carbonyloxy)phenyl]-2-oxo-ethyl] 7-chloro-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 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] 7-chloro-3,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 7-chloro-3,8-dimethyl-2-phenyl-cinchoninic acid [2-[4-(2-furoyloxy)phenyl]-2-keto-ethyl] ester Formula: C31H22ClNO6 MolecularWeight: 539.96248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C(C(=C(N=C12)C3=CC=CC=C3)C)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CO5)Cl

Isomeric SMILES

CC1=C(C=CC2=C(C(=C(N=C12)C3=CC=CC=C3)C)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CO5)Cl

InChI

InChI=1S/C31H22ClNO6/c1-18-24(32)15-14-23-27(19(2)28(33-29(18)23)21-7-4-3-5-8-21)31(36)38-17-25(34)20-10-12-22(13-11-20)39-30(35)26-9-6-16-37-26/h3-16H,17H2,1-2H3