4-bromanyl-3-[methyl-[2-(3-methylphenoxy)ethyl]sulfamoyl]benzoic acid

Systemtic Name: 4-bromanyl-3-[methyl-[2-(3-methylphenoxy)ethyl]sulfamoyl]benzoic acid Openeye Name: 4-bromo-3-[methyl-[2-(3-methylphenoxy)ethyl]sulfamoyl]benzoic acid CAS Name: 4-bromo-3-[methyl-[2-(3-methylphenoxy)ethyl]sulfamoyl]benzoic acid IUPAC Name: 4-bromo-3-[methyl-[2-(3-methylphenoxy)ethyl]sulfamoyl]benzoic acid Traditional Name: 4-bromo-3-[methyl-[2-(3-methylphenoxy)ethyl]sulfamoyl]benzoic acid Formula: C17H18BrNO5S MolecularWeight: 428.29752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCN(C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

Isomeric SMILES

CC1=CC(=CC=C1)OCCN(C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

InChI

InChI=1S/C17H18BrNO5S/c1-12-4-3-5-14(10-12)24-9-8-19(2)25(22,23)16-11-13(17(20)21)6-7-15(16)18/h3-7,10-11H,8-9H2,1-2H3,(H,20,21)