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

Systemtic Name: 2-[4-(4-chlorophenyl)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 2-[[4-(4-chlorophenyl)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 2-[[4-(4-chlorophenyl)-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 2-[4-(4-chlorophenyl)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 2-[4-(4-chlorophenyl)piperidino]sulfonylbenzoic acid Formula: C18H18ClNO4S MolecularWeight: 379.85782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCC1C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H18ClNO4S/c19-15-7-5-13(6-8-15)14-9-11-20(12-10-14)25(23,24)17-4-2-1-3-16(17)18(21)22/h1-8,14H,9-12H2,(H,21,22)