4-[3-[2-[[2,6-bis(fluoranyl)phenyl]methoxy]-5-chloranyl-phenyl]thiophen-2-yl]-3-methyl-benzoate

Systemtic Name: 4-[3-[2-[[2,6-bis(fluoranyl)phenyl]methoxy]-5-chloranyl-phenyl]thiophen-2-yl]-3-methyl-benzoate Openeye Name: 4-[3-[5-chloro-2-[(2,6-difluorophenyl)methoxy]phenyl]-2-thienyl]-3-methyl-benzoate CAS Name: 4-[3-[5-chloro-2-[(2,6-difluorophenyl)methoxy]phenyl]-2-thiophenyl]-3-methylbenzoate IUPAC Name: 4-[3-[5-chloro-2-[(2,6-difluorophenyl)methoxy]phenyl]thiophen-2-yl]-3-methylbenzoate Traditional Name: 4-[3-[5-chloro-2-(2,6-difluorobenzyl)oxy-phenyl]-2-thienyl]-3-methyl-benzoate Formula: C25H16ClF2O3S- MolecularWeight: 469.907546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)[O-])C2=C(C=CS2)C3=C(C=CC(=C3)Cl)OCC4=C(C=CC=C4F)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[O-])C2=C(C=CS2)C3=C(C=CC(=C3)Cl)OCC4=C(C=CC=C4F)F

InChI

InChI=1S/C25H17ClF2O3S/c1-14-11-15(25(29)30)5-7-17(14)24-18(9-10-32-24)19-12-16(26)6-8-23(19)31-13-20-21(27)3-2-4-22(20)28/h2-12H,13H2,1H3,(H,29,30)/p-1