2-[(2R,5S,6S)-6-(diethoxyphosphorylmethyl)-5-methyl-oxan-2-yl]ethyl benzoate

Systemtic Name: 2-[(2R,5S,6S)-6-(diethoxyphosphorylmethyl)-5-methyl-oxan-2-yl]ethyl benzoate Openeye Name: 2-[(2R,5S,6S)-6-(diethoxyphosphorylmethyl)-5-methyl-tetrahydropyran-2-yl]ethyl benzoate CAS Name: benzoic acid 2-[(2R,5S,6S)-6-(diethoxyphosphorylmethyl)-5-methyl-2-oxanyl]ethyl ester IUPAC Name: 2-[(2R,5S,6S)-6-(diethoxyphosphorylmethyl)-5-methyloxan-2-yl]ethyl benzoate Traditional Name: benzoic acid 2-[(2R,5S,6S)-6-(diethoxyphosphorylmethyl)-5-methyl-tetrahydropyran-2-yl]ethyl ester Formula: C20H31O6P MolecularWeight: 398.430301

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1C(CCC(O1)CCOC(=O)C2=CC=CC=C2)C)OCC

Isomeric SMILES

CCOP(=O)(C[C@@H]1[C@H](CC[C@@H](O1)CCOC(=O)C2=CC=CC=C2)C)OCC

InChI

InChI=1S/C20H31O6P/c1-4-24-27(22,25-5-2)15-19-16(3)11-12-18(26-19)13-14-23-20(21)17-9-7-6-8-10-17/h6-10,16,18-19H,4-5,11-15H2,1-3H3/t16-,18+,19+/m0/s1