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

Systemtic Name: N-(tert-butylcarbamoyl)-2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(tert-butylcarbamoyl)-2-(7-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-(7-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(tert-butylcarbamoyl)-2-(7-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(tert-butylcarbamoyl)-2-(4-keto-7-nitro-quinazolin-3-yl)acetamide Formula: C15H17N5O5 MolecularWeight: 347.32598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N5O5/c1-15(2,3)18-14(23)17-12(21)7-19-8-16-11-6-9(20(24)25)4-5-10(11)13(19)22/h4-6,8H,7H2,1-3H3,(H2,17,18,21,23)