N-(4-methylphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline

Systemtic Name: N-(4-methylphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline Openeye Name: 2-nitro-N-(p-tolyl)-4-(trifluoromethylsulfonyl)aniline CAS Name: N-(4-methylphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline IUPAC Name: N-(4-methylphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline Traditional Name: (2-nitro-4-triflyl-phenyl)-(p-tolyl)amine Formula: C14H11F3N2O4S MolecularWeight: 360.30835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H11F3N2O4S/c1-9-2-4-10(5-3-9)18-12-7-6-11(8-13(12)19(20)21)24(22,23)14(15,16)17/h2-8,18H,1H3