1-(5-carboxy-2-chloranyl-phenyl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(5-carboxy-2-chloranyl-phenyl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(5-carboxy-2-chloro-phenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-(5-carboxy-2-chlorophenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-(5-carboxy-2-chlorophenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-(5-carboxy-2-chloro-phenyl)sulfonylisonipecotic acid Formula: C13H14ClNO6S MolecularWeight: 347.77136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C13H14ClNO6S/c14-10-2-1-9(13(18)19)7-11(10)22(20,21)15-5-3-8(4-6-15)12(16)17/h1-2,7-8H,3-6H2,(H,16,17)(H,18,19)