1-(5-chloranyl-2-cyano-phenyl)sulfonylpiperidine-2-carboxylic acid

Systemtic Name: 1-(5-chloranyl-2-cyano-phenyl)sulfonylpiperidine-2-carboxylic acid Openeye Name: 1-(5-chloro-2-cyano-phenyl)sulfonylpiperidine-2-carboxylic acid CAS Name: 1-(5-chloro-2-cyanophenyl)sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 1-(5-chloro-2-cyanophenyl)sulfonylpiperidine-2-carboxylic acid Traditional Name: 1-(5-chloro-2-cyano-phenyl)sulfonylpipecolinic acid Formula: C13H13ClN2O4S MolecularWeight: 328.77132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C13H13ClN2O4S/c14-10-5-4-9(8-15)12(7-10)21(19,20)16-6-2-1-3-11(16)13(17)18/h4-5,7,11H,1-3,6H2,(H,17,18)