7-nitro-3-[[2-(trifluoromethyl)phenyl]methyl]quinazolin-4-one

Systemtic Name: 7-nitro-3-[[2-(trifluoromethyl)phenyl]methyl]quinazolin-4-one Openeye Name: 7-nitro-3-[[2-(trifluoromethyl)phenyl]methyl]quinazolin-4-one CAS Name: 7-nitro-3-[[2-(trifluoromethyl)phenyl]methyl]-4-quinazolinone IUPAC Name: 7-nitro-3-[[2-(trifluoromethyl)phenyl]methyl]quinazolin-4-one Traditional Name: 7-nitro-3-[2-(trifluoromethyl)benzyl]quinazolin-4-one Formula: C16H10F3N3O3 MolecularWeight: 349.26411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H10F3N3O3/c17-16(18,19)13-4-2-1-3-10(13)8-21-9-20-14-7-11(22(24)25)5-6-12(14)15(21)23/h1-7,9H,8H2