(3,3-dimethyl-2-oxidanylidene-butyl) 6-bromanyl-7-chloranyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 6-bromanyl-7-chloranyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 6-bromo-7-chloro-3,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-7-chloro-3,8-dimethyl-2-phenyl-4-quinolinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 6-bromo-7-chloro-3,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-7-chloro-3,8-dimethyl-2-phenyl-cinchoninic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C24H23BrClNO3 MolecularWeight: 488.80132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23BrClNO3/c1-13-19(23(29)30-12-18(28)24(3,4)5)16-11-17(25)20(26)14(2)22(16)27-21(13)15-9-7-6-8-10-15/h6-11H,12H2,1-5H3