1-[4-(4-chloranylphenoxy)phenyl]sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[4-(4-chloranylphenoxy)phenyl]sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-[4-(4-chlorophenoxy)phenyl]sulfonylpiperidine-4-carboxylic acid CAS Name: 1-[4-(4-chlorophenoxy)phenyl]sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-[4-(4-chlorophenoxy)phenyl]sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-[4-(4-chlorophenoxy)phenyl]sulfonylisonipecotic acid Formula: C18H18ClNO5S MolecularWeight: 395.85722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClNO5S/c19-14-1-3-15(4-2-14)25-16-5-7-17(8-6-16)26(23,24)20-11-9-13(10-12-20)18(21)22/h1-8,13H,9-12H2,(H,21,22)