3-[4-[ethyl(propan-2-yl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[ethyl(propan-2-yl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[ethyl(isopropyl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[ethyl(propan-2-yl)sulfamoyl]-3,5-dimethyl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[ethyl(propan-2-yl)sulfamoyl]-3,5-dimethylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[ethyl(isopropyl)sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propionic acid Formula: C13H23N3O4S MolecularWeight: 317.40442

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)C)S(=O)(=O)C1=C(N(N=C1C)CCC(=O)O)C

Isomeric SMILES

CCN(C(C)C)S(=O)(=O)C1=C(N(N=C1C)CCC(=O)O)C

InChI

InChI=1S/C13H23N3O4S/c1-6-16(9(2)3)21(19,20)13-10(4)14-15(11(13)5)8-7-12(17)18/h9H,6-8H2,1-5H3,(H,17,18)