[2-[4-(4-bromophenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-bromanyl-8-ethyl-3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-(4-bromophenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-bromanyl-8-ethyl-3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[4-(4-bromobenzoyl)oxyphenyl]-2-oxo-ethyl] 6-bromo-8-ethyl-3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-8-ethyl-3-methyl-2-phenyl-4-quinolinecarboxylic acid [2-[4-[(4-bromophenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-bromobenzoyl)oxyphenyl]-2-oxoethyl] 6-bromo-8-ethyl-3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-8-ethyl-3-methyl-2-phenyl-cinchoninic acid [2-[4-(4-bromobenzoyl)oxyphenyl]-2-keto-ethyl] ester Formula: C34H25Br2NO5 MolecularWeight: 687.374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H25Br2NO5/c1-3-21-17-26(36)18-28-30(20(2)31(37-32(21)28)23-7-5-4-6-8-23)34(40)41-19-29(38)22-11-15-27(16-12-22)42-33(39)24-9-13-25(35)14-10-24/h4-18H,3,19H2,1-2H3