2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-(7-nitro-4-oxo-quinazolin-3-yl)-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-(7-nitro-4-oxo-3-quinazolinyl)-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-(7-nitro-4-oxoquinazolin-3-yl)-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-(4-keto-7-nitro-quinazolin-3-yl)-N-(2,2,2-trifluoroethyl)acetamide Formula: C12H9F3N4O4 MolecularWeight: 330.21947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])N=CN(C2=O)CC(=O)NCC(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])N=CN(C2=O)CC(=O)NCC(F)(F)F

InChI

InChI=1S/C12H9F3N4O4/c13-12(14,15)5-16-10(20)4-18-6-17-9-3-7(19(22)23)1-2-8(9)11(18)21/h1-3,6H,4-5H2,(H,16,20)