3,5-dimethyl-1-(1-oxidanylidene-1-piperidin-1-yl-propan-2-yl)pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-(1-oxidanylidene-1-piperidin-1-yl-propan-2-yl)pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-[1-methyl-2-oxo-2-(1-piperidyl)ethyl]pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[1-oxo-1-(1-piperidinyl)propan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-(1-oxo-1-piperidin-1-ylpropan-2-yl)pyrazole-4-carboxylic acid Traditional Name: 1-(2-keto-1-methyl-2-piperidino-ethyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)N2CCCCC2)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)N2CCCCC2)C)C(=O)O

InChI

InChI=1S/C14H21N3O3/c1-9-12(14(19)20)10(2)17(15-9)11(3)13(18)16-7-5-4-6-8-16/h11H,4-8H2,1-3H3,(H,19,20)