1-[2,3,4-tris(chloranyl)phenyl]sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[2,3,4-tris(chloranyl)phenyl]sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(2,3,4-trichlorophenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-(2,3,4-trichlorophenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-(2,3,4-trichlorophenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-(2,3,4-trichlorophenyl)sulfonylisonipecotic acid Formula: C12H12Cl3NO4S MolecularWeight: 372.65198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12Cl3NO4S/c13-8-1-2-9(11(15)10(8)14)21(19,20)16-5-3-7(4-6-16)12(17)18/h1-2,7H,3-6H2,(H,17,18)