2-[3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonylpyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonylpyrazol-1-yl]ethanoic acid Openeye Name: 2-[3-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]pyrazol-1-yl]acetic acid CAS Name: 2-[3-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[3-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[3-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]pyrazol-1-yl]acetic acid Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=NN(C=C2)CC(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3/c1-9-5-10(2)7-15(6-9)13(19)11-3-4-16(14-11)8-12(17)18/h3-4,9-10H,5-8H2,1-2H3,(H,17,18)/t9-,10-/m0/s1