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

Systemtic Name: 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-piperidyl]acetic acid Formula: C12H19N3O4S MolecularWeight: 301.36196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)N2CCC(CC2)CC(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N2CCC(CC2)CC(=O)O

InChI

InChI=1S/C12H19N3O4S/c1-8-12(9(2)14-13-8)20(18,19)15-5-3-10(4-6-15)7-11(16)17/h10H,3-7H2,1-2H3,(H,13,14)(H,16,17)