(2S)-1-[(2R)-2-pyrazol-1-ylpropanoyl]piperidine-2-carboxylate

Systemtic Name: (2S)-1-[(2R)-2-pyrazol-1-ylpropanoyl]piperidine-2-carboxylate Openeye Name: (2S)-1-[(2R)-2-pyrazol-1-ylpropanoyl]piperidine-2-carboxylate CAS Name: (2S)-1-[(2R)-1-oxo-2-(1-pyrazolyl)propyl]-2-piperidinecarboxylate IUPAC Name: (2S)-1-[(2R)-2-pyrazol-1-ylpropanoyl]piperidine-2-carboxylate Traditional Name: (2S)-1-[(2R)-2-pyrazol-1-ylpropanoyl]pipecolinate Formula: C12H16N3O3- MolecularWeight: 250.27374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1C(=O)[O-])N2C=CC=N2

Isomeric SMILES

C[C@H](C(=O)N1CCCC[C@H]1C(=O)[O-])N2C=CC=N2

InChI

InChI=1S/C12H17N3O3/c1-9(15-8-4-6-13-15)11(16)14-7-3-2-5-10(14)12(17)18/h4,6,8-10H,2-3,5,7H2,1H3,(H,17,18)/p-1/t9-,10+/m1/s1