N-(4-bromanyl-3-methyl-phenyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-(6-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-(6-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-(4-keto-6-nitro-quinazolin-3-yl)acetamide Formula: C17H13BrN4O4 MolecularWeight: 417.21352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H13BrN4O4/c1-10-6-11(2-4-14(10)18)20-16(23)8-21-9-19-15-5-3-12(22(25)26)7-13(15)17(21)24/h2-7,9H,8H2,1H3,(H,20,23)