(5-methyl-2-nitro-phenyl) 2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoate

Systemtic Name: (5-methyl-2-nitro-phenyl) 2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoate Openeye Name: (5-methyl-2-nitro-phenyl) 2-(6-bromo-4-oxo-quinazolin-3-yl)acetate CAS Name: 2-(6-bromo-4-oxo-3-quinazolinyl)acetic acid (5-methyl-2-nitrophenyl) ester IUPAC Name: (5-methyl-2-nitrophenyl) 2-(6-bromo-4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(6-bromo-4-keto-quinazolin-3-yl)acetic acid (5-methyl-2-nitro-phenyl) ester Formula: C17H12BrN3O5 MolecularWeight: 418.19828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrN3O5/c1-10-2-5-14(21(24)25)15(6-10)26-16(22)8-20-9-19-13-4-3-11(18)7-12(13)17(20)23/h2-7,9H,8H2,1H3