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

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]ethanamide Openeye Name: 2-[4-[benzyl(methylsulfonyl)amino]phenoxy]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]acetamide IUPAC Name: 2-[4-[benzyl(methylsulfonyl)amino]phenoxy]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[4-[benzyl(mesyl)amino]phenoxy]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C23H23N3O6S MolecularWeight: 469.51022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H23N3O6S/c1-17-8-9-20(26(28)29)14-22(17)24-23(27)16-32-21-12-10-19(11-13-21)25(33(2,30)31)15-18-6-4-3-5-7-18/h3-14H,15-16H2,1-2H3,(H,24,27)