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

Systemtic Name: 1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonylisonipecotic acid Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)S(=O)(=O)N2CCC(CC2)C(=O)O)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)S(=O)(=O)N2CCC(CC2)C(=O)O)C

InChI

InChI=1S/C13H21N3O4S/c1-4-16-10(3)12(9(2)14-16)21(19,20)15-7-5-11(6-8-15)13(17)18/h11H,4-8H2,1-3H3,(H,17,18)