(2S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-2-carboxylate

Systemtic Name: (2S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-2-carboxylate Openeye Name: (2S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-2-carboxylate CAS Name: (2S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-2-piperidinecarboxylate IUPAC Name: (2S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-2-carboxylate Traditional Name: (2S)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]pipecolinate Formula: C11H16N3O4S- MolecularWeight: 286.32744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)N2CCCCC2C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N2CCCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C11H17N3O4S/c1-7-10(8(2)13-12-7)19(17,18)14-6-4-3-5-9(14)11(15)16/h9H,3-6H2,1-2H3,(H,12,13)(H,15,16)/p-1/t9-/m0/s1