2-[methylsulfonyl-(3-nitrophenyl)amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[methylsulfonyl-(3-nitrophenyl)amino]-N-phenethyl-ethanamide Openeye Name: 2-(N-methylsulfonyl-3-nitro-anilino)-N-phenethyl-acetamide CAS Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-phenethylacetamide IUPAC Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-phenethylacetamide Traditional Name: 2-(N-mesyl-3-nitro-anilino)-N-phenethyl-acetamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCC1=CC=CC=C1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCC1=CC=CC=C1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S/c1-26(24,25)19(15-8-5-9-16(12-15)20(22)23)13-17(21)18-11-10-14-6-3-2-4-7-14/h2-9,12H,10-11,13H2,1H3,(H,18,21)