N-(3-chloranyl-2-methyl-phenyl)-2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-nitro-anilino]-N-(3-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-(3-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-(3-chloro-2-methylphenyl)acetamide Traditional Name: 2-(N-besyl-4-nitro-anilino)-N-(3-chloro-2-methyl-phenyl)acetamide Formula: C21H18ClN3O5S MolecularWeight: 459.90272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CN(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CN(C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

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