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

Systemtic Name: 3-(6-nitro-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: 3-(6-nitro-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-nitro-4-oxo-3-quinazolinyl)propanoate IUPAC Name: 3-(6-nitro-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-keto-6-nitro-quinazolin-3-yl)propionate Formula: C11H8N3O5- MolecularWeight: 262.19832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C=N2)CCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C=N2)CCC(=O)[O-]

InChI

InChI=1S/C11H9N3O5/c15-10(16)3-4-13-6-12-9-2-1-7(14(18)19)5-8(9)11(13)17/h1-2,5-6H,3-4H2,(H,15,16)/p-1