6-nitro-2-(trifluoromethyl)spiro[1H-quinazoline-4,4'-cyclohexa-2,5-diene]-1'-one

Systemtic Name: 6-nitro-2-(trifluoromethyl)spiro[1H-quinazoline-4,4'-cyclohexa-2,5-diene]-1'-one Openeye Name: 6-nitro-2-(trifluoromethyl)spiro[1H-quinazoline-4,4'-cyclohexa-2,5-diene]-1'-one CAS Name: 6-nitro-2-(trifluoromethyl)-1'-spiro[1H-quinazoline-4,4'-cyclohexa-2,5-diene]one IUPAC Name: 6-nitro-2-(trifluoromethyl)spiro[1H-quinazoline-4,4'-cyclohexa-2,5-diene]-1'-one Traditional Name: 6-nitro-2-(trifluoromethyl)spiro[1H-quinazoline-4,4'-cyclohexa-2,5-diene]-1'-one Formula: C14H8F3N3O3 MolecularWeight: 323.22683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C3(C=CC(=O)C=C3)N=C(N2)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C3(C=CC(=O)C=C3)N=C(N2)C(F)(F)F

InChI

InChI=1S/C14H8F3N3O3/c15-14(16,17)12-18-11-2-1-8(20(22)23)7-10(11)13(19-12)5-3-9(21)4-6-13/h1-7H,(H,18,19)