N-[1-(3,4-dimethoxyphenyl)ethyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C20H25N3O8S MolecularWeight: 467.4928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O8S/c1-13(14-6-8-18(30-3)19(10-14)31-4)21-20(24)12-22(32(5,27)28)16-11-15(23(25)26)7-9-17(16)29-2/h6-11,13H,12H2,1-5H3,(H,21,24)