1-(1,5-dimethylpyrazol-4-yl)carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(1,5-dimethylpyrazol-4-yl)carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(1,5-dimethylpyrazole-4-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(1,5-dimethyl-4-pyrazolyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(1,5-dimethylpyrazole-4-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(1,5-dimethylpyrazole-4-carbonyl)nipecotic acid Formula: C12H17N3O3 MolecularWeight: 251.28168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CC1=C(C=NN1C)C(=O)N2CCCC(C2)C(=O)O

InChI

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