4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-2-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-2-methyl-pyrazole-3-carboxylic acid Openeye Name: 4-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-2-methyl-pyrazole-3-carboxylic acid CAS Name: 4-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-2-methylpyrazole-3-carboxylic acid Traditional Name: 4-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-2-methyl-pyrazole-3-carboxylic acid Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=C(N(N=C2)C)C(=O)O)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)C2=C(N(N=C2)C)C(=O)O)C

InChI

InChI=1S/C13H19N3O3/c1-8-4-9(2)7-16(6-8)12(17)10-5-14-15(3)11(10)13(18)19/h5,8-9H,4,6-7H2,1-3H3,(H,18,19)/t8-,9-/m0/s1