2-[(4-methylsulfonyl-2-nitro-phenyl)amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[(4-methylsulfonyl-2-nitro-phenyl)amino]-N-phenethyl-ethanamide Openeye Name: 2-(4-methylsulfonyl-2-nitro-anilino)-N-phenethyl-acetamide CAS Name: 2-(4-methylsulfonyl-2-nitroanilino)-N-phenethylacetamide IUPAC Name: 2-(4-methylsulfonyl-2-nitroanilino)-N-phenethylacetamide Traditional Name: 2-(4-mesyl-2-nitro-anilino)-N-phenethyl-acetamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCC(=O)NCCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCC(=O)NCCC2=CC=CC=C2)[N+](=O)[O-]

InChI

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