5-(2-ethylpiperidin-1-yl)-1,3-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-(2-ethylpiperidin-1-yl)-1,3-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 5-(2-ethyl-1-piperidyl)-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 5-(2-ethyl-1-piperidinyl)-1,3-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazole-4-carboxylic acid Traditional Name: 5-(2-ethylpiperidino)-1,3-dimethyl-pyrazole-4-carboxylic acid Formula: C13H21N3O2 MolecularWeight: 251.32474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NN2C)C)C(=O)O

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NN2C)C)C(=O)O

InChI

InChI=1S/C13H21N3O2/c1-4-10-7-5-6-8-16(10)12-11(13(17)18)9(2)14-15(12)3/h10H,4-8H2,1-3H3,(H,17,18)