2-[3,5-dimethyl-4-(3-oxidanylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[3,5-dimethyl-4-(3-oxidanylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[(3-hydroxy-1-piperidyl)sulfonyl]-3,5-dimethyl-pyrazol-1-yl]acetic acid CAS Name: 2-[4-[(3-hydroxy-1-piperidinyl)sulfonyl]-3,5-dimethyl-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(3-hydroxypiperidin-1-yl)sulfonyl-3,5-dimethylpyrazol-1-yl]acetic acid Traditional Name: 2-[4-(3-hydroxypiperidino)sulfonyl-3,5-dimethyl-pyrazol-1-yl]acetic acid Formula: C12H19N3O5S MolecularWeight: 317.36136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)O)C)S(=O)(=O)N2CCCC(C2)O

Isomeric SMILES

CC1=C(C(=NN1CC(=O)O)C)S(=O)(=O)N2CCCC(C2)O

InChI

InChI=1S/C12H19N3O5S/c1-8-12(9(2)15(13-8)7-11(17)18)21(19,20)14-5-3-4-10(16)6-14/h10,16H,3-7H2,1-2H3,(H,17,18)