2-[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]-3-(6-oxidanylnaphthalen-1-yl)-2-[4,4,5,5,5-pentakis(fluoranyl)pentyl]dodecanoic acid

Systemtic Name: 2-[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]-3-(6-oxidanylnaphthalen-1-yl)-2-[4,4,5,5,5-pentakis(fluoranyl)pentyl]dodecanoic acid Openeye Name: 2-(3,5-difluoro-4-hydroxy-phenyl)-3-(6-hydroxy-1-naphthyl)-2-(4,4,5,5,5-pentafluoropentyl)dodecanoic acid CAS Name: 2-(3,5-difluoro-4-hydroxyphenyl)-3-(6-hydroxy-1-naphthalenyl)-2-(4,4,5,5,5-pentafluoropentyl)dodecanoic acid IUPAC Name: 2-(3,5-difluoro-4-hydroxyphenyl)-3-(6-hydroxynaphthalen-1-yl)-2-(4,4,5,5,5-pentafluoropentyl)dodecanoic acid Traditional Name: 2-(3,5-difluoro-4-hydroxy-phenyl)-3-(6-hydroxy-1-naphthyl)-2-(4,4,5,5,5-pentafluoropentyl)lauric acid Formula: C33H37F7O4 MolecularWeight: 630.633302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C1=CC=CC2=C1C=CC(=C2)O)C(CCCC(C(F)(F)F)(F)F)(C3=CC(=C(C(=C3)F)O)F)C(=O)O

Isomeric SMILES

CCCCCCCCCC(C1=CC=CC2=C1C=CC(=C2)O)C(CCCC(C(F)(F)F)(F)F)(C3=CC(=C(C(=C3)F)O)F)C(=O)O

InChI

InChI=1S/C33H37F7O4/c1-2-3-4-5-6-7-8-13-26(25-12-9-11-21-18-23(41)14-15-24(21)25)31(30(43)44,16-10-17-32(36,37)33(38,39)40)22-19-27(34)29(42)28(35)20-22/h9,11-12,14-15,18-20,26,41-42H,2-8,10,13,16-17H2,1H3,(H,43,44)