2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[(4-chlorophenyl)methyl-(p-tolylsulfonyl)amino]-N-(3-nitrophenyl)acetamide CAS Name: 2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[(4-chlorobenzyl)-tosyl-amino]-N-(3-nitrophenyl)acetamide Formula: C22H20ClN3O5S MolecularWeight: 473.9293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Cl)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Cl)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN3O5S/c1-16-5-11-21(12-6-16)32(30,31)25(14-17-7-9-18(23)10-8-17)15-22(27)24-19-3-2-4-20(13-19)26(28)29/h2-13H,14-15H2,1H3,(H,24,27)