4-bromanyl-3-[(2-methyl-5-nitro-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-bromanyl-3-[(2-methyl-5-nitro-phenyl)sulfamoyl]benzoic acid Openeye Name: 4-bromo-3-[(2-methyl-5-nitro-phenyl)sulfamoyl]benzoic acid CAS Name: 4-bromo-3-[(2-methyl-5-nitrophenyl)sulfamoyl]benzoic acid IUPAC Name: 4-bromo-3-[(2-methyl-5-nitrophenyl)sulfamoyl]benzoic acid Traditional Name: 4-bromo-3-[(2-methyl-5-nitro-phenyl)sulfamoyl]benzoic acid Formula: C14H11BrN2O6S MolecularWeight: 415.21594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11BrN2O6S/c1-8-2-4-10(17(20)21)7-12(8)16-24(22,23)13-6-9(14(18)19)3-5-11(13)15/h2-7,16H,1H3,(H,18,19)