7-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[methyl-[4-(trifluoromethyl)benzyl]amino]-6-nitro-1H-quinazolin-4-one Formula: C17H13F3N4O3 MolecularWeight: 378.30533

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(F)(F)F)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(F)(F)F)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H13F3N4O3/c1-23(8-10-2-4-11(5-3-10)17(18,19)20)14-7-13-12(6-15(14)24(26)27)16(25)22-9-21-13/h2-7,9H,8H2,1H3,(H,21,22,25)