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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CNCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

InChI

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