N-[(3,4-dimethoxyphenyl)methyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: 2-(N-mesyl-2-methoxy-5-nitro-anilino)-N-veratryl-acetamide Formula: C19H23N3O8S MolecularWeight: 453.46622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C

InChI

InChI=1S/C19H23N3O8S/c1-28-16-8-6-14(22(24)25)10-15(16)21(31(4,26)27)12-19(23)20-11-13-5-7-17(29-2)18(9-13)30-3/h5-10H,11-12H2,1-4H3,(H,20,23)