ethyl 1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylisonipecotic acid ethyl ester Formula: C13H20ClN3O4S MolecularWeight: 349.8336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)C)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)C)Cl

InChI

InChI=1S/C13H20ClN3O4S/c1-4-21-13(18)10-5-7-17(8-6-10)22(19,20)11-9(2)15-16(3)12(11)14/h10H,4-8H2,1-3H3