2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)-N-(3-nitrophenyl)acetamide CAS Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-(3-nitrophenyl)acetamide IUPAC Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)-N-(3-nitrophenyl)acetamide Traditional Name: 2-(4-bromo-N-mesyl-3-methyl-anilino)-N-(3-nitrophenyl)acetamide Formula: C16H16BrN3O5S MolecularWeight: 442.28434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrN3O5S/c1-11-8-13(6-7-15(11)17)19(26(2,24)25)10-16(21)18-12-4-3-5-14(9-12)20(22)23/h3-9H,10H2,1-2H3,(H,18,21)