(7-bromanyl-3-ethanoyl-2-methyl-1-benzofuran-5-yl)-(3-nitrophenyl)sulfonyl-azanide

Systemtic Name: (7-bromanyl-3-ethanoyl-2-methyl-1-benzofuran-5-yl)-(3-nitrophenyl)sulfonyl-azanide Openeye Name: (3-acetyl-7-bromo-2-methyl-benzofuran-5-yl)-(3-nitrophenyl)sulfonyl-azanide CAS Name: (3-acetyl-7-bromo-2-methyl-5-benzofuranyl)-(3-nitrophenyl)sulfonylazanide IUPAC Name: (3-acetyl-7-bromo-2-methyl-1-benzofuran-5-yl)-(3-nitrophenyl)sulfonylazanide Traditional Name: (3-acetyl-7-bromo-2-methyl-benzofuran-5-yl)-(3-nitrophenyl)sulfonyl-azanide Formula: C17H12BrN2O6S- MolecularWeight: 452.25598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=CC(=C2O1)Br)[N-]S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C2=CC(=CC(=C2O1)Br)[N-]S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C17H12BrN2O6S/c1-9(21)16-10(2)26-17-14(16)6-11(7-15(17)18)19-27(24,25)13-5-3-4-12(8-13)20(22)23/h3-8H,1-2H3/q-1