2-[4-(4-chloranylphenoxy)piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 2-[4-(4-chloranylphenoxy)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 2-[[4-(4-chlorophenoxy)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 2-[[4-(4-chlorophenoxy)-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 2-[4-(4-chlorophenoxy)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 2-[4-(4-chlorophenoxy)piperidino]sulfonylbenzoic acid Formula: C18H18ClNO5S MolecularWeight: 395.85722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCC1OC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3C(=O)O

InChI

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