3-[[4-[(4-dibenzofuran-4-yl-3-fluoranyl-phenyl)methoxy]-2-fluoranyl-phenyl]methylsulfanyl]-2-methyl-propanoic acid

Systemtic Name: 3-[[4-[(4-dibenzofuran-4-yl-3-fluoranyl-phenyl)methoxy]-2-fluoranyl-phenyl]methylsulfanyl]-2-methyl-propanoic acid Openeye Name: 3-[[4-[(4-dibenzofuran-4-yl-3-fluoro-phenyl)methoxy]-2-fluoro-phenyl]methylsulfanyl]-2-methyl-propanoic acid CAS Name: 3-[[4-[[4-(4-dibenzofuranyl)-3-fluorophenyl]methoxy]-2-fluorophenyl]methylthio]-2-methylpropanoic acid IUPAC Name: 3-[[4-[(4-dibenzofuran-4-yl-3-fluorophenyl)methoxy]-2-fluorophenyl]methylsulfanyl]-2-methylpropanoic acid Traditional Name: 3-[[4-(4-dibenzofuran-4-yl-3-fluoro-benzyl)oxy-2-fluoro-benzyl]thio]-2-methyl-propionic acid Formula: C30H24F2O4S MolecularWeight: 518.570966

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=C(C=C(C=C1)OCC2=CC(=C(C=C2)C3=CC=CC4=C3OC5=CC=CC=C45)F)F)C(=O)O

Isomeric SMILES

CC(CSCC1=C(C=C(C=C1)OCC2=CC(=C(C=C2)C3=CC=CC4=C3OC5=CC=CC=C45)F)F)C(=O)O

InChI

InChI=1S/C30H24F2O4S/c1-18(30(33)34)16-37-17-20-10-11-21(14-26(20)31)35-15-19-9-12-22(27(32)13-19)24-6-4-7-25-23-5-2-3-8-28(23)36-29(24)25/h2-14,18H,15-17H2,1H3,(H,33,34)