1-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]pyrazole-4-carboxylate

Systemtic Name: 1-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]pyrazole-4-carboxylate Openeye Name: 1-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]pyrazole-4-carboxylate CAS Name: 1-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-4-pyrazolecarboxylate IUPAC Name: 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]pyrazole-4-carboxylate Traditional Name: 1-[2-keto-2-(4-methylpiperidino)ethyl]pyrazole-4-carboxylate Formula: C12H16N3O3- MolecularWeight: 250.27374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CN2C=C(C=N2)C(=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)CN2C=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C12H17N3O3/c1-9-2-4-14(5-3-9)11(16)8-15-7-10(6-13-15)12(17)18/h6-7,9H,2-5,8H2,1H3,(H,17,18)/p-1