4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]-2-nitro-phenolate

Systemtic Name: 4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]-2-nitro-phenolate Openeye Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]-2-nitro-phenolate CAS Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]-2-nitrophenolate IUPAC Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]-2-nitrophenolate Traditional Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]-2-nitro-phenolate Formula: C14H10BrN2O7S- MolecularWeight: 430.2074

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)NS(=O)(=O)C3=CC(=C(C=C3)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)NS(=O)(=O)C3=CC(=C(C=C3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H11BrN2O7S/c15-9-6-13-14(24-4-3-23-13)7-10(9)16-25(21,22)8-1-2-12(18)11(5-8)17(19)20/h1-2,5-7,16,18H,3-4H2/p-1