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

Systemtic Name: 3-[4-[methyl-[(2-piperidin-1-ylphenyl)methyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[methyl-[[2-(1-piperidyl)phenyl]methyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[methyl-[[2-(1-piperidinyl)phenyl]methyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[methyl-[(2-piperidin-1-ylphenyl)methyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[methyl-(2-piperidinobenzyl)sulfamoyl]phenyl]propionic acid Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C22H28N2O4S/c1-23(17-19-7-3-4-8-21(19)24-15-5-2-6-16-24)29(27,28)20-12-9-18(10-13-20)11-14-22(25)26/h3-4,7-10,12-13H,2,5-6,11,14-17H2,1H3,(H,25,26)