7-[3-[3,5-bis(trifluoromethyl)phenyl]propyl-methylsulfonyl-amino]heptanoic acid

Systemtic Name: 7-[3-[3,5-bis(trifluoromethyl)phenyl]propyl-methylsulfonyl-amino]heptanoic acid Openeye Name: 7-[3-[3,5-bis(trifluoromethyl)phenyl]propyl-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[3-[3,5-bis(trifluoromethyl)phenyl]propyl-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[3-[3,5-bis(trifluoromethyl)phenyl]propyl-methylsulfonylamino]heptanoic acid Traditional Name: 7-[3-[3,5-bis(trifluoromethyl)phenyl]propyl-mesyl-amino]enanthic acid Formula: C19H25F6NO4S MolecularWeight: 477.461519

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CCCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)CCCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H25F6NO4S/c1-31(29,30)26(9-5-3-2-4-8-17(27)28)10-6-7-14-11-15(18(20,21)22)13-16(12-14)19(23,24)25/h11-13H,2-10H2,1H3,(H,27,28)