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

Systemtic Name: N-(3,5-dimethylphenyl)-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-(3,5-dimethylphenyl)-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: N-(3,5-dimethylphenyl)-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CN(C2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CN(C2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C)C

InChI

InChI=1S/C18H21N3O6S/c1-12-7-13(2)9-14(8-12)19-18(22)11-20(28(4,25)26)16-10-15(21(23)24)5-6-17(16)27-3/h5-10H,11H2,1-4H3,(H,19,22)