[2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-2-(4-methoxyphenyl)-3,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-2-(4-methoxyphenyl)-3,8-dimethyl-quinoline-4-carboxylate Openeye Name: [2-(4-acetoxyphenyl)-2-oxo-ethyl] 6-bromo-7-chloro-2-(4-methoxyphenyl)-3,8-dimethyl-quinoline-4-carboxylate CAS Name: 6-bromo-7-chloro-2-(4-methoxyphenyl)-3,8-dimethyl-4-quinolinecarboxylic acid [2-(4-acetyloxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyloxyphenyl)-2-oxoethyl] 6-bromo-7-chloro-2-(4-methoxyphenyl)-3,8-dimethylquinoline-4-carboxylate Traditional Name: 6-bromo-7-chloro-2-(4-methoxyphenyl)-3,8-dimethyl-cinchoninic acid [2-(4-acetoxyphenyl)-2-keto-ethyl] ester Formula: C29H23BrClNO6 MolecularWeight: 596.85302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H23BrClNO6/c1-15-25(29(35)37-14-24(34)18-5-11-21(12-6-18)38-17(3)33)22-13-23(30)26(31)16(2)28(22)32-27(15)19-7-9-20(36-4)10-8-19/h5-13H,14H2,1-4H3