ethyl 3-(6-nitro-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: ethyl 3-(6-nitro-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: ethyl 3-(6-nitro-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-nitro-4-oxo-3-quinazolinyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(6-nitro-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-keto-6-nitro-quinazolin-3-yl)propionic acid ethyl ester Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN1C=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O5/c1-2-21-12(17)5-6-15-8-14-11-4-3-9(16(19)20)7-10(11)13(15)18/h3-4,7-8H,2,5-6H2,1H3