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

Systemtic Name: 2-methylpropyl 4-[(6-bromanyl-8-methyl-2-phenyl-quinolin-4-yl)carbonylamino]benzoate Openeye Name: isobutyl 4-[(6-bromo-8-methyl-2-phenyl-quinoline-4-carbonyl)amino]benzoate CAS Name: 4-[[(6-bromo-8-methyl-2-phenyl-4-quinolinyl)-oxomethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(6-bromo-8-methyl-2-phenylquinoline-4-carbonyl)amino]benzoate Traditional Name: 4-[(6-bromo-8-methyl-2-phenyl-quinoline-4-carbonyl)amino]benzoic acid isobutyl ester Formula: C28H25BrN2O3 MolecularWeight: 517.4137

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCC(C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCC(C)C

InChI

InChI=1S/C28H25BrN2O3/c1-17(2)16-34-28(33)20-9-11-22(12-10-20)30-27(32)24-15-25(19-7-5-4-6-8-19)31-26-18(3)13-21(29)14-23(24)26/h4-15,17H,16H2,1-3H3,(H,30,32)