methyl 2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoate

Systemtic Name: methyl 2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoate Openeye Name: methyl 2-(7-nitro-4-oxo-quinazolin-3-yl)acetate CAS Name: 2-(7-nitro-4-oxo-3-quinazolinyl)acetic acid methyl ester IUPAC Name: methyl 2-(7-nitro-4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-keto-7-nitro-quinazolin-3-yl)acetic acid methyl ester Formula: C11H9N3O5 MolecularWeight: 263.20626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O5/c1-19-10(15)5-13-6-12-9-4-7(14(17)18)2-3-8(9)11(13)16/h2-4,6H,5H2,1H3