4-methyl-3-[methyl-[(2-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoic acid

Systemtic Name: 4-methyl-3-[methyl-[(2-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoic acid Openeye Name: 4-methyl-3-[methyl-[[2-(1-piperidyl)phenyl]methyl]sulfamoyl]benzoic acid CAS Name: 4-methyl-3-[methyl-[[2-(1-piperidinyl)phenyl]methyl]sulfamoyl]benzoic acid IUPAC Name: 4-methyl-3-[methyl-[(2-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoic acid Traditional Name: 4-methyl-3-[methyl-(2-piperidinobenzyl)sulfamoyl]benzoic acid Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(C)CC2=CC=CC=C2N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(C)CC2=CC=CC=C2N3CCCCC3

InChI

InChI=1S/C21H26N2O4S/c1-16-10-11-17(21(24)25)14-20(16)28(26,27)22(2)15-18-8-4-5-9-19(18)23-12-6-3-7-13-23/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,24,25)