2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(propylcarbamoyl)ethanamide

Systemtic Name: 2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(propylcarbamoyl)ethanamide Openeye Name: 2-(7-nitro-4-oxo-quinazolin-3-yl)-N-(propylcarbamoyl)acetamide CAS Name: 2-(7-nitro-4-oxo-3-quinazolinyl)-N-[oxo(propylamino)methyl]acetamide IUPAC Name: 2-(7-nitro-4-oxoquinazolin-3-yl)-N-(propylcarbamoyl)acetamide Traditional Name: 2-(4-keto-7-nitro-quinazolin-3-yl)-N-(propylcarbamoyl)acetamide Formula: C14H15N5O5 MolecularWeight: 333.2994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5O5/c1-2-5-15-14(22)17-12(20)7-18-8-16-11-6-9(19(23)24)3-4-10(11)13(18)21/h3-4,6,8H,2,5,7H2,1H3,(H2,15,17,20,22)