3-[4-(azetidin-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-(azetidin-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(azetidin-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid CAS Name: 3-[4-(1-azetidinylsulfonyl)-3,5-dimethyl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(azetidin-1-ylsulfonyl)-3,5-dimethylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(azetidin-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]propionic acid Formula: C11H17N3O4S MolecularWeight: 287.33538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)N2CCC2

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)N2CCC2

InChI

InChI=1S/C11H17N3O4S/c1-8-11(19(17,18)13-5-3-6-13)9(2)14(12-8)7-4-10(15)16/h3-7H2,1-2H3,(H,15,16)