[1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-(3-chlorophenyl)-8-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-(3-chlorophenyl)-8-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl] 6-bromo-2-(3-chlorophenyl)-8-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(3-chlorophenyl)-8-ethyl-3-methyl-4-quinolinecarboxylic acid [1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methoxyphenyl)-1-oxopropan-2-yl] 6-bromo-2-(3-chlorophenyl)-8-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(3-chlorophenyl)-8-ethyl-3-methyl-cinchoninic acid [2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl] ester Formula: C29H25BrClNO4 MolecularWeight: 566.8701

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H25BrClNO4/c1-5-18-13-21(30)15-24-25(16(2)26(32-27(18)24)20-7-6-8-22(31)14-20)29(34)36-17(3)28(33)19-9-11-23(35-4)12-10-19/h6-15,17H,5H2,1-4H3