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

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)-N-(4-phenoxyphenyl)acetamide CAS Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-(N-mesyl-2-methyl-5-nitro-anilino)-N-(4-phenoxyphenyl)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-])N(CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

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