3-fluoranyl-4-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)aniline

Systemtic Name: 3-fluoranyl-4-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)aniline Openeye Name: 3-fluoro-4-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)aniline CAS Name: 3-fluoro-4-methyl-N-(4-methylsulfonyl-2-nitrophenyl)aniline IUPAC Name: 3-fluoro-4-methyl-N-(4-methylsulfonyl-2-nitrophenyl)aniline Traditional Name: (3-fluoro-4-methyl-phenyl)-(4-mesyl-2-nitro-phenyl)amine Formula: C14H13FN2O4S MolecularWeight: 324.327423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13FN2O4S/c1-9-3-4-10(7-12(9)15)16-13-6-5-11(22(2,20)21)8-14(13)17(18)19/h3-8,16H,1-2H3