1-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonylpiperidine-3-carboxylic acid Openeye Name: 1-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-[(1-ethyl-5-methyl-4-pyrazolyl)sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(1-ethyl-5-methylpyrazol-4-yl)sulfonylpiperidine-3-carboxylic acid Traditional Name: 1-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonylnipecotic acid Formula: C12H19N3O4S MolecularWeight: 301.36196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)S(=O)(=O)N2CCCC(C2)C(=O)O)C

Isomeric SMILES

CCN1C(=C(C=N1)S(=O)(=O)N2CCCC(C2)C(=O)O)C

InChI

InChI=1S/C12H19N3O4S/c1-3-15-9(2)11(7-13-15)20(18,19)14-6-4-5-10(8-14)12(16)17/h7,10H,3-6,8H2,1-2H3,(H,16,17)