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

Systemtic Name: 3-[4-[methyl(pentan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[methyl(1-methylbutyl)sulfamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[methyl(pentan-2-yl)sulfamoyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[methyl(pentan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[methyl(1-methylbutyl)sulfamoyl]pyrazol-1-yl]propionic acid Formula: C12H21N3O4S MolecularWeight: 303.37784

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N(C)S(=O)(=O)C1=CN(N=C1)CCC(=O)O

Isomeric SMILES

CCCC(C)N(C)S(=O)(=O)C1=CN(N=C1)CCC(=O)O

InChI

InChI=1S/C12H21N3O4S/c1-4-5-10(2)14(3)20(18,19)11-8-13-15(9-11)7-6-12(16)17/h8-10H,4-7H2,1-3H3,(H,16,17)