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

Systemtic Name: N-(4-bromanyl-3-chloranyl-phenyl)-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(4-bromo-3-chloro-phenyl)-2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-(4-bromo-3-chlorophenyl)-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-(4-bromo-3-chlorophenyl)-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: N-(4-bromo-3-chloro-phenyl)-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C16H15BrClN3O6S MolecularWeight: 492.7288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC(=C(C=C2)Br)Cl)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC(=C(C=C2)Br)Cl)S(=O)(=O)C

InChI

InChI=1S/C16H15BrClN3O6S/c1-27-15-6-4-11(21(23)24)8-14(15)20(28(2,25)26)9-16(22)19-10-3-5-12(17)13(18)7-10/h3-8H,9H2,1-2H3,(H,19,22)