1-[3-chloranyl-4-[4-[3-[1-[4-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]propyl]piperidin-1-yl]phenyl]sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[3-chloranyl-4-[4-[3-[1-[4-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]propyl]piperidin-1-yl]phenyl]sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-[3-chloro-4-[4-[3-[1-[4-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]propyl]-1-piperidyl]phenyl]sulfonylpiperidine-4-carboxylic acid CAS Name: 1-[3-chloro-4-[4-[3-[1-[4-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]propyl]-1-piperidinyl]phenyl]sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-[3-chloro-4-[4-[3-[1-[4-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]propyl]piperidin-1-yl]phenyl]sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-[3-chloro-4-[4-[3-[1-[4-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]propyl]piperidino]phenyl]sulfonylisonipecotic acid Formula: C32H41ClF3N3O6S2 MolecularWeight: 720.26265

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F)C4=C(C=C(C=C4)S(=O)(=O)N5CCC(CC5)C(=O)O)Cl

Isomeric SMILES

C1CN(CCC1CCCC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F)C4=C(C=C(C=C4)S(=O)(=O)N5CCC(CC5)C(=O)O)Cl

InChI

InChI=1S/C32H41ClF3N3O6S2/c33-29-22-28(47(44,45)39-20-14-25(15-21-39)31(40)41)8-9-30(29)37-16-10-23(11-17-37)2-1-3-24-12-18-38(19-13-24)46(42,43)27-6-4-26(5-7-27)32(34,35)36/h4-9,22-25H,1-3,10-21H2,(H,40,41)