2-bromanyl-1-[diethoxyphosphoryl-bis(fluoranyl)methyl]-4-[(4-methylsulfonylphenyl)methoxymethyl]benzene

Systemtic Name: 2-bromanyl-1-[diethoxyphosphoryl-bis(fluoranyl)methyl]-4-[(4-methylsulfonylphenyl)methoxymethyl]benzene Openeye Name: 2-bromo-1-[diethoxyphosphoryl(difluoro)methyl]-4-[(4-methylsulfonylphenyl)methoxymethyl]benzene CAS Name: 2-bromo-1-[diethoxyphosphoryl(difluoro)methyl]-4-[(4-methylsulfonylphenyl)methoxymethyl]benzene IUPAC Name: 2-bromo-1-[diethoxyphosphoryl(difluoro)methyl]-4-[(4-methylsulfonylphenyl)methoxymethyl]benzene Traditional Name: 2-bromo-1-[diethoxyphosphoryl(difluoro)methyl]-4-[(4-mesylbenzyl)oxymethyl]benzene Formula: C20H24BrF2O6PS MolecularWeight: 541.340527

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=C(C=C(C=C1)COCC2=CC=C(C=C2)S(=O)(=O)C)Br)(F)F)OCC

Isomeric SMILES

CCOP(=O)(C(C1=C(C=C(C=C1)COCC2=CC=C(C=C2)S(=O)(=O)C)Br)(F)F)OCC

InChI

InChI=1S/C20H24BrF2O6PS/c1-4-28-30(24,29-5-2)20(22,23)18-11-8-16(12-19(18)21)14-27-13-15-6-9-17(10-7-15)31(3,25)26/h6-12H,4-5,13-14H2,1-3H3