N-(2-ethyl-6-methyl-phenyl)-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-(N-methylsulfonyl-3-nitro-anilino)acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-(N-methylsulfonyl-3-nitroanilino)acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(N-methylsulfonyl-3-nitroanilino)acetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-(N-mesyl-3-nitro-anilino)acetamide Formula: C18H21N3O5S MolecularWeight: 391.44144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C)C

InChI

InChI=1S/C18H21N3O5S/c1-4-14-8-5-7-13(2)18(14)19-17(22)12-20(27(3,25)26)15-9-6-10-16(11-15)21(23)24/h5-11H,4,12H2,1-3H3,(H,19,22)