2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)ethanoic acid

Systemtic Name: 2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)ethanoic acid Openeye Name: 2-[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]acetic acid CAS Name: 2-[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]acetic acid IUPAC Name: 2-(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)acetic acid Traditional Name: 2-(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)acetic acid Formula: C12H19N3O4S MolecularWeight: 301.36196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)O)C)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C(=NN1CC(=O)O)C)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C12H19N3O4S/c1-9-12(10(2)15(13-9)8-11(16)17)20(18,19)14-6-4-3-5-7-14/h3-8H2,1-2H3,(H,16,17)