[(2R)-1-diethoxyphosphoryl-1,1-bis(fluoranyl)-6-methyl-hept-5-en-2-yl] (2R)-2-phenylpropanoate

Systemtic Name: [(2R)-1-diethoxyphosphoryl-1,1-bis(fluoranyl)-6-methyl-hept-5-en-2-yl] (2R)-2-phenylpropanoate Openeye Name: [(1R)-1-[diethoxyphosphoryl(difluoro)methyl]-5-methyl-hex-4-enyl] (2R)-2-phenylpropanoate CAS Name: (2R)-2-phenylpropanoic acid [(2R)-1-diethoxyphosphoryl-1,1-difluoro-6-methylhept-5-en-2-yl] ester IUPAC Name: [(2R)-1-diethoxyphosphoryl-1,1-difluoro-6-methylhept-5-en-2-yl] (2R)-2-phenylpropanoate Traditional Name: (2R)-2-phenylpropionic acid [(1R)-1-[diethoxyphosphoryl(difluoro)methyl]-5-methyl-hex-4-enyl] ester Formula: C21H31F2O5P MolecularWeight: 432.438407

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C(CCC=C(C)C)OC(=O)C(C)C1=CC=CC=C1)(F)F)OCC

Isomeric SMILES

CCOP(=O)(C([C@@H](CCC=C(C)C)OC(=O)[C@H](C)C1=CC=CC=C1)(F)F)OCC

InChI

InChI=1S/C21H31F2O5P/c1-6-26-29(25,27-7-2)21(22,23)19(15-11-12-16(3)4)28-20(24)17(5)18-13-9-8-10-14-18/h8-10,12-14,17,19H,6-7,11,15H2,1-5H3/t17-,19-/m1/s1