(4-chloranyl-1-ethyl-pyrazol-3-yl)-[(3S,5S)-3,5-dimethylpiperidin-1-yl]methanone

Systemtic Name: (4-chloranyl-1-ethyl-pyrazol-3-yl)-[(3S,5S)-3,5-dimethylpiperidin-1-yl]methanone Openeye Name: (4-chloro-1-ethyl-pyrazol-3-yl)-[(3S,5S)-3,5-dimethyl-1-piperidyl]methanone CAS Name: (4-chloro-1-ethyl-3-pyrazolyl)-[(3S,5S)-3,5-dimethyl-1-piperidinyl]methanone IUPAC Name: (4-chloro-1-ethylpyrazol-3-yl)-[(3S,5S)-3,5-dimethylpiperidin-1-yl]methanone Traditional Name: (4-chloro-1-ethyl-pyrazol-3-yl)-[(3S,5S)-3,5-dimethylpiperidino]methanone Formula: C13H20ClN3O MolecularWeight: 269.7704

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N2CC(CC(C2)C)C)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N2C[C@H](C[C@@H](C2)C)C)Cl

InChI

InChI=1S/C13H20ClN3O/c1-4-17-8-11(14)12(15-17)13(18)16-6-9(2)5-10(3)7-16/h8-10H,4-7H2,1-3H3/t9-,10-/m0/s1