2-bromanyl-5-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoic acid

Systemtic Name: 2-bromanyl-5-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoic acid Openeye Name: 2-bromo-5-[methyl-[[4-(1-piperidyl)phenyl]methyl]sulfamoyl]benzoic acid CAS Name: 2-bromo-5-[methyl-[[4-(1-piperidinyl)phenyl]methyl]sulfamoyl]benzoic acid IUPAC Name: 2-bromo-5-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoic acid Traditional Name: 2-bromo-5-[methyl-(4-piperidinobenzyl)sulfamoyl]benzoic acid Formula: C20H23BrN2O4S MolecularWeight: 467.37662

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)S(=O)(=O)C3=CC(=C(C=C3)Br)C(=O)O

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)S(=O)(=O)C3=CC(=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C20H23BrN2O4S/c1-22(28(26,27)17-9-10-19(21)18(13-17)20(24)25)14-15-5-7-16(8-6-15)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12,14H2,1H3,(H,24,25)