S-[(2R)-1-bis(chloranyl)phosphoryloxy-3-hexoxy-propan-2-yl] (E)-pent-2-enethioate

Systemtic Name: S-[(2R)-1-bis(chloranyl)phosphoryloxy-3-hexoxy-propan-2-yl] (E)-pent-2-enethioate Openeye Name: S-[(1R)-1-(dichlorophosphoryloxymethyl)-2-hexoxy-ethyl] (E)-pent-2-enethioate CAS Name: (E)-2-pentenethioic acid S-[(2R)-1-dichlorophosphoryloxy-3-hexoxypropan-2-yl] ester IUPAC Name: S-[(2R)-1-dichlorophosphoryloxy-3-hexoxypropan-2-yl] (E)-pent-2-enethioate Traditional Name: (E)-pent-2-enethioic acid S-[(1R)-1-(dichlorophosphoryloxymethyl)-2-hexoxy-ethyl] ester Formula: C14H25Cl2O4PS MolecularWeight: 391.290661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC(COP(=O)(Cl)Cl)SC(=O)C=CCC

Isomeric SMILES

CCCCCCOC[C@H](COP(=O)(Cl)Cl)SC(=O)/C=C/CC

InChI

InChI=1S/C14H25Cl2O4PS/c1-3-5-7-8-10-19-11-13(12-20-21(15,16)18)22-14(17)9-6-4-2/h6,9,13H,3-5,7-8,10-12H2,1-2H3/b9-6+/t13-/m1/s1