N-[(2S)-3-methylbutan-2-yl]-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-(6-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[(2S)-3-methylbutan-2-yl]-2-(6-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[(1S)-1,2-dimethylpropyl]-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)C(C)NC(=O)CN1C=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O4/c1-9(2)10(3)17-14(20)7-18-8-16-13-5-4-11(19(22)23)6-12(13)15(18)21/h4-6,8-10H,7H2,1-3H3,(H,17,20)/t10-/m0/s1