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

Systemtic Name: 6-nitro-2-(phenylmethyl)-3-[[3-(trifluoromethyl)phenyl]methyl]quinazolin-4-one Openeye Name: 2-benzyl-6-nitro-3-[[3-(trifluoromethyl)phenyl]methyl]quinazolin-4-one CAS Name: 6-nitro-2-(phenylmethyl)-3-[[3-(trifluoromethyl)phenyl]methyl]-4-quinazolinone IUPAC Name: 2-benzyl-6-nitro-3-[[3-(trifluoromethyl)phenyl]methyl]quinazolin-4-one Traditional Name: 2-benzyl-6-nitro-3-[3-(trifluoromethyl)benzyl]quinazolin-4-one Formula: C23H16F3N3O3 MolecularWeight: 439.38665

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H16F3N3O3/c24-23(25,26)17-8-4-7-16(11-17)14-28-21(12-15-5-2-1-3-6-15)27-20-10-9-18(29(31)32)13-19(20)22(28)30/h1-11,13H,12,14H2