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

Systemtic Name: 6-nitro-3-[[4-(trifluoromethyl)phenyl]methyl]quinazolin-4-one Openeye Name: 6-nitro-3-[[4-(trifluoromethyl)phenyl]methyl]quinazolin-4-one CAS Name: 6-nitro-3-[[4-(trifluoromethyl)phenyl]methyl]-4-quinazolinone IUPAC Name: 6-nitro-3-[[4-(trifluoromethyl)phenyl]methyl]quinazolin-4-one Traditional Name: 6-nitro-3-[4-(trifluoromethyl)benzyl]quinazolin-4-one Formula: C16H10F3N3O3 MolecularWeight: 349.26411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

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