1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-3-carboxylic acid CAS Name: 1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]nipecotic acid Formula: C11H17N3O4S MolecularWeight: 287.33538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C11H17N3O4S/c1-7-10(8(2)13-12-7)19(17,18)14-5-3-4-9(6-14)11(15)16/h9H,3-6H2,1-2H3,(H,12,13)(H,15,16)