N-(3-methylbutyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-(3-methylbutyl)-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-isopentyl-2-(6-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(3-methylbutyl)-2-(6-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(3-methylbutyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-isoamyl-2-(4-keto-6-nitro-quinazolin-3-yl)acetamide Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O4/c1-10(2)5-6-16-14(20)8-18-9-17-13-4-3-11(19(22)23)7-12(13)15(18)21/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,16,20)