ethyl N-[2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoyl]carbamate

Systemtic Name: ethyl N-[2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoyl]carbamate Openeye Name: ethyl N-[2-(7-nitro-4-oxo-quinazolin-3-yl)acetyl]carbamate CAS Name: N-[2-(7-nitro-4-oxo-3-quinazolinyl)-1-oxoethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(7-nitro-4-oxoquinazolin-3-yl)acetyl]carbamate Traditional Name: N-[2-(4-keto-7-nitro-quinazolin-3-yl)acetyl]carbamic acid ethyl ester Formula: C13H12N4O6 MolecularWeight: 320.25758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O6/c1-2-23-13(20)15-11(18)6-16-7-14-10-5-8(17(21)22)3-4-9(10)12(16)19/h3-5,7H,2,6H2,1H3,(H,15,18,20)