[2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 2-[4-[5,6-bis(bromanyl)-1,3-bis(oxidanylidene)-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]phenyl]-6-chloranyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 2-[4-[5,6-bis(bromanyl)-1,3-bis(oxidanylidene)-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]phenyl]-6-chloranyl-quinoline-4-carboxylate Openeye Name: [2-(4-fluorophenyl)-2-oxo-ethyl] 6-chloro-2-[4-(5,6-dibromo-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)phenyl]quinoline-4-carboxylate CAS Name: 6-chloro-2-[4-(5,6-dibromo-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)phenyl]-4-quinolinecarboxylic acid [2-(4-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-fluorophenyl)-2-oxoethyl] 6-chloro-2-[4-(5,6-dibromo-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)phenyl]quinoline-4-carboxylate Traditional Name: 6-chloro-2-[4-(5,6-dibromo-1,3-diketo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)phenyl]cinchoninic acid [2-(4-fluorophenyl)-2-keto-ethyl] ester Formula: C32H22Br2ClFN2O5 MolecularWeight: 728.786883

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(CC(C1Br)Br)C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=C(C=C(C=C5)Cl)C(=C4)C(=O)OCC(=O)C6=CC=C(C=C6)F

Isomeric SMILES

C1C2C(CC(C1Br)Br)C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=C(C=C(C=C5)Cl)C(=C4)C(=O)OCC(=O)C6=CC=C(C=C6)F

InChI

InChI=1S/C32H22Br2ClFN2O5/c33-25-12-22-23(13-26(25)34)31(41)38(30(22)40)20-8-3-16(4-9-20)28-14-24(21-11-18(35)5-10-27(21)37-28)32(42)43-15-29(39)17-1-6-19(36)7-2-17/h1-11,14,22-23,25-26H,12-13,15H2