(2,3-dimethylphenyl) 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: (2,3-dimethylphenyl) 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: (2,3-dimethylphenyl) 2-(4-bromophenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-8-methyl-4-quinolinecarboxylic acid (2,3-dimethylphenyl) ester IUPAC Name: (2,3-dimethylphenyl) 2-(4-bromophenyl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-8-methyl-cinchoninic acid (2,3-dimethylphenyl) ester Formula: C25H20BrNO2 MolecularWeight: 446.3358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C25H20BrNO2/c1-15-6-5-9-23(17(15)3)29-25(28)21-14-22(18-10-12-19(26)13-11-18)27-24-16(2)7-4-8-20(21)24/h4-14H,1-3H3