N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-[(2-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-[(2-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(2-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-(2-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-(2-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(N-mesyl-2-methyl-anilino)acetamide Formula: C20H25N3O7S MolecularWeight: 451.4934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O7S/c1-14-7-5-6-8-16(14)22(31(4,27)28)13-20(24)21-10-9-15-11-18(29-2)19(30-3)12-17(15)23(25)26/h5-8,11-12H,9-10,13H2,1-4H3,(H,21,24)