1-(2-cyanophenyl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(2-cyanophenyl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(2-cyanophenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-(2-cyanophenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-(2-cyanophenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-(2-cyanophenyl)sulfonylisonipecotic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C13H14N2O4S/c14-9-11-3-1-2-4-12(11)20(18,19)15-7-5-10(6-8-15)13(16)17/h1-4,10H,5-8H2,(H,16,17)