5-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: 5-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: 5-[(3S,5S)-3,5-dimethyl-1-piperidyl]-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-1,3-dimethyl-4-pyrazolecarboxylate IUPAC Name: 5-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-[(3S,5S)-3,5-dimethylpiperidino]-1,3-dimethyl-pyrazole-4-carboxylate Formula: C13H20N3O2- MolecularWeight: 250.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C(=NN2C)C)C(=O)[O-])C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C2=C(C(=NN2C)C)C(=O)[O-])C

InChI

InChI=1S/C13H21N3O2/c1-8-5-9(2)7-16(6-8)12-11(13(17)18)10(3)14-15(12)4/h8-9H,5-7H2,1-4H3,(H,17,18)/p-1/t8-,9-/m0/s1