3-[4-[(2-methylphenyl)sulfamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[(2-methylphenyl)sulfamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(o-tolylsulfamoyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[(2-methylphenyl)sulfamoyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[(2-methylphenyl)sulfamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(o-tolylsulfamoyl)pyrazol-1-yl]propionic acid Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CN(N=C2)CCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CN(N=C2)CCC(=O)O

InChI

InChI=1S/C13H15N3O4S/c1-10-4-2-3-5-12(10)15-21(19,20)11-8-14-16(9-11)7-6-13(17)18/h2-5,8-9,15H,6-7H2,1H3,(H,17,18)