N-(2-methyl-6-nitro-phenyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine Openeye Name: N-(2-methyl-6-nitro-phenyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine CAS Name: N-(2-methyl-6-nitrophenyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine IUPAC Name: N-(2-methyl-6-nitrophenyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine Traditional Name: (2-methyl-6-nitro-phenyl)-[4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-yl]amine Formula: C16H15F3N4O2 MolecularWeight: 352.31111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC2=NC3=C(CCCC3)C(=N2)C(F)(F)F

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC2=NC3=C(CCCC3)C(=N2)C(F)(F)F

InChI

InChI=1S/C16H15F3N4O2/c1-9-5-4-8-12(23(24)25)13(9)21-15-20-11-7-3-2-6-10(11)14(22-15)16(17,18)19/h4-5,8H,2-3,6-7H2,1H3,(H,20,21,22)