methyl 4-[[6-bromanyl-3,8-dimethyl-2-(4-methylphenyl)quinolin-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[6-bromanyl-3,8-dimethyl-2-(4-methylphenyl)quinolin-4-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[6-bromo-3,8-dimethyl-2-(p-tolyl)quinoline-4-carbonyl]amino]benzoate CAS Name: 4-[[[6-bromo-3,8-dimethyl-2-(4-methylphenyl)-4-quinolinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-bromo-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carbonyl]amino]benzoate Traditional Name: 4-[[6-bromo-3,8-dimethyl-2-(p-tolyl)quinoline-4-carbonyl]amino]benzoic acid methyl ester Formula: C27H23BrN2O3 MolecularWeight: 503.38712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)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(=C2C)C(=O)NC4=CC=C(C=C4)C(=O)OC)Br)C

InChI

InChI=1S/C27H23BrN2O3/c1-15-5-7-18(8-6-15)25-17(3)23(22-14-20(28)13-16(2)24(22)30-25)26(31)29-21-11-9-19(10-12-21)27(32)33-4/h5-14H,1-4H3,(H,29,31)