propan-2-yl 4-[(5-bromanylpyridin-3-yl)carbonylamino]-2-methyl-quinoline-6-carboxylate

Systemtic Name: propan-2-yl 4-[(5-bromanylpyridin-3-yl)carbonylamino]-2-methyl-quinoline-6-carboxylate Openeye Name: isopropyl 4-[(5-bromopyridine-3-carbonyl)amino]-2-methyl-quinoline-6-carboxylate CAS Name: 4-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-2-methyl-6-quinolinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(5-bromopyridine-3-carbonyl)amino]-2-methylquinoline-6-carboxylate Traditional Name: 4-[(5-bromonicotinoyl)amino]-2-methyl-quinoline-6-carboxylic acid isopropyl ester Formula: C20H18BrN3O3 MolecularWeight: 428.27922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)OC(C)C)C(=C1)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)OC(C)C)C(=C1)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C20H18BrN3O3/c1-11(2)27-20(26)13-4-5-17-16(8-13)18(6-12(3)23-17)24-19(25)14-7-15(21)10-22-9-14/h4-11H,1-3H3,(H,23,24,25)