N-[3-(2-methoxyphenyl)propyl]-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[3-(2-methoxyphenyl)propyl]-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-(2-methoxyphenyl)propyl]-2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-[3-(2-methoxyphenyl)propyl]-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-[3-(2-methoxyphenyl)propyl]-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: 2-(N-mesyl-2-methyl-5-nitro-anilino)-N-[3-(2-methoxyphenyl)propyl]acetamide Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCCCC2=CC=CC=C2OC)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCCCC2=CC=CC=C2OC)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O6S/c1-15-10-11-17(23(25)26)13-18(15)22(30(3,27)28)14-20(24)21-12-6-8-16-7-4-5-9-19(16)29-2/h4-5,7,9-11,13H,6,8,12,14H2,1-3H3,(H,21,24)