4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-N-(2-methyl-5-nitro-phenyl)butanamide

Systemtic Name: 4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-N-(2-methyl-5-nitro-phenyl)butanamide Openeye Name: 4-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)-N-(2-methyl-5-nitro-phenyl)butanamide CAS Name: 4-(6,7-dimethoxy-4-oxo-3-quinazolinyl)-N-(2-methyl-5-nitrophenyl)butanamide IUPAC Name: 4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-methyl-5-nitrophenyl)butanamide Traditional Name: 4-(4-keto-6,7-dimethoxy-quinazolin-3-yl)-N-(2-methyl-5-nitro-phenyl)butyramide Formula: C21H22N4O6 MolecularWeight: 426.42258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

InChI

InChI=1S/C21H22N4O6/c1-13-6-7-14(25(28)29)9-16(13)23-20(26)5-4-8-24-12-22-17-11-19(31-3)18(30-2)10-15(17)21(24)27/h6-7,9-12H,4-5,8H2,1-3H3,(H,23,26)