2-[4-[(4-methylphenyl)methyl-methylsulfonyl-amino]phenoxy]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[4-[(4-methylphenyl)methyl-methylsulfonyl-amino]phenoxy]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[4-[methylsulfonyl(p-tolylmethyl)amino]phenoxy]-N-(3-nitrophenyl)acetamide CAS Name: 2-[4-[(4-methylphenyl)methyl-methylsulfonylamino]phenoxy]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[4-[(4-methylphenyl)methyl-methylsulfonylamino]phenoxy]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[4-[mesyl-(4-methylbenzyl)amino]phenoxy]-N-(3-nitrophenyl)acetamide Formula: C23H23N3O6S MolecularWeight: 469.51022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

InChI

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