methyl 4-[[6-bromanyl-8-methyl-2-(4-methylphenyl)quinolin-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[6-bromanyl-8-methyl-2-(4-methylphenyl)quinolin-4-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[6-bromo-8-methyl-2-(p-tolyl)quinoline-4-carbonyl]amino]benzoate CAS Name: 4-[[[6-bromo-8-methyl-2-(4-methylphenyl)-4-quinolinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-bromo-8-methyl-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzoate Traditional Name: 4-[[6-bromo-8-methyl-2-(p-tolyl)quinoline-4-carbonyl]amino]benzoic acid methyl ester Formula: C26H21BrN2O3 MolecularWeight: 489.36054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)OC)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)OC)Br)C

InChI

InChI=1S/C26H21BrN2O3/c1-15-4-6-17(7-5-15)23-14-22(21-13-19(27)12-16(2)24(21)29-23)25(30)28-20-10-8-18(9-11-20)26(31)32-3/h4-14H,1-3H3,(H,28,30)