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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-(4-methylsulfonyl-2-nitro-anilino)acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-(4-methylsulfonyl-2-nitroanilino)acetamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-(4-methylsulfonyl-2-nitroanilino)acetamide Traditional Name: 2-(4-mesyl-2-nitro-anilino)-N-p-anisyl-acetamide Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O6S/c1-26-13-5-3-12(4-6-13)10-19-17(21)11-18-15-8-7-14(27(2,24)25)9-16(15)20(22)23/h3-9,18H,10-11H2,1-2H3,(H,19,21)