1-[3-(3,5-dimethylpyrazol-1-yl)propanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(3,5-dimethylpyrazol-1-yl)propanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(3,5-dimethylpyrazol-1-yl)propanoyl]piperidine-3-carboxylic acid CAS Name: 1-[3-(3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(3,5-dimethylpyrazol-1-yl)propanoyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(3,5-dimethylpyrazol-1-yl)propanoyl]nipecotic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)N2CCCC(C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)N2CCCC(C2)C(=O)O)C

InChI

InChI=1S/C14H21N3O3/c1-10-8-11(2)17(15-10)7-5-13(18)16-6-3-4-12(9-16)14(19)20/h8,12H,3-7,9H2,1-2H3,(H,19,20)