N-(3,4-dimethoxyphenyl)-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-(N-methylsulfonyl-3-nitro-anilino)acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-(N-methylsulfonyl-3-nitroanilino)acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-(N-methylsulfonyl-3-nitroanilino)acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-(N-mesyl-3-nitro-anilino)acetamide Formula: C17H19N3O7S MolecularWeight: 409.41366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C)OC

InChI

InChI=1S/C17H19N3O7S/c1-26-15-8-7-12(9-16(15)27-2)18-17(21)11-19(28(3,24)25)13-5-4-6-14(10-13)20(22)23/h4-10H,11H2,1-3H3,(H,18,21)