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

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-(2-methoxy-5-nitro-phenyl)ethanamide Openeye Name: 2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)-N-(2-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-(2-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-(2-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-(4-bromo-N-mesyl-3-methyl-anilino)-N-(2-methoxy-5-nitro-phenyl)acetamide Formula: C17H18BrN3O6S MolecularWeight: 472.31032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N(CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C)Br

InChI

InChI=1S/C17H18BrN3O6S/c1-11-8-12(4-6-14(11)18)20(28(3,25)26)10-17(22)19-15-9-13(21(23)24)5-7-16(15)27-2/h4-9H,10H2,1-3H3,(H,19,22)