[[2-bromanyl-4-(methylsulfanylmethyl)phenyl]-bis(fluoranyl)methyl]phosphonic acid

Systemtic Name: [[2-bromanyl-4-(methylsulfanylmethyl)phenyl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[2-bromo-4-(methylsulfanylmethyl)phenyl]-difluoro-methyl]phosphonic acid CAS Name: [[2-bromo-4-[(methylthio)methyl]phenyl]-difluoromethyl]phosphonic acid IUPAC Name: [[2-bromo-4-(methylsulfanylmethyl)phenyl]-difluoromethyl]phosphonic acid Traditional Name: [[2-bromo-4-[(methylthio)methyl]phenyl]-difluoro-methyl]phosphonic acid Formula: C9H10BrF2O3PS MolecularWeight: 347.113467

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC(=C(C=C1)C(F)(F)P(=O)(O)O)Br

Isomeric SMILES

CSCC1=CC(=C(C=C1)C(F)(F)P(=O)(O)O)Br

InChI

InChI=1S/C9H10BrF2O3PS/c1-17-5-6-2-3-7(8(10)4-6)9(11,12)16(13,14)15/h2-4H,5H2,1H3,(H2,13,14,15)