(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 5-bromanylpyridine-3-carboxylate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C16H12BrN3O3 MolecularWeight: 374.18878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H12BrN3O3/c1-9-3-2-4-12-14(9)19-13(20-15(12)21)8-23-16(22)10-5-11(17)7-18-6-10/h2-7H,8H2,1H3,(H,19,20,21)