N-(2-methyl-5-nitro-phenyl)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-(N-methylsulfonyl-4-phenoxy-anilino)acetamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H21N3O6S/c1-16-8-9-18(25(27)28)14-21(16)23-22(26)15-24(32(2,29)30)17-10-12-20(13-11-17)31-19-6-4-3-5-7-19/h3-14H,15H2,1-2H3,(H,23,26)