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

Systemtic Name: N-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonyl-(3-nitrophenyl)amino]ethanamide Openeye Name: N-(4-chlorophenyl)-2-[3-nitro-N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-(4-chlorophenyl)-2-(N-(4-methylphenyl)sulfonyl-3-nitroanilino)acetamide IUPAC Name: N-(4-chlorophenyl)-2-(N-(4-methylphenyl)sulfonyl-3-nitroanilino)acetamide Traditional Name: N-(4-chlorophenyl)-2-(3-nitro-N-tosyl-anilino)acetamide Formula: C21H18ClN3O5S MolecularWeight: 459.90272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O5S/c1-15-5-11-20(12-6-15)31(29,30)24(18-3-2-4-19(13-18)25(27)28)14-21(26)23-17-9-7-16(22)8-10-17/h2-13H,14H2,1H3,(H,23,26)