S-[(2R)-1-hexoxy-3-[methoxy(oxidanyl)phosphoryl]oxy-propan-2-yl] (E)-pent-2-enethioate

Systemtic Name: S-[(2R)-1-hexoxy-3-[methoxy(oxidanyl)phosphoryl]oxy-propan-2-yl] (E)-pent-2-enethioate Openeye Name: S-[(1R)-1-(hexoxymethyl)-2-[hydroxy(methoxy)phosphoryl]oxy-ethyl] (E)-pent-2-enethioate CAS Name: (E)-2-pentenethioic acid S-[(2R)-1-hexoxy-3-[hydroxy(methoxy)phosphoryl]oxypropan-2-yl] ester IUPAC Name: S-[(2R)-1-hexoxy-3-[hydroxy(methoxy)phosphoryl]oxypropan-2-yl] (E)-pent-2-enethioate Traditional Name: (E)-pent-2-enethioic acid S-[(1R)-1-(hexoxymethyl)-2-[hydroxy(methoxy)phosphoryl]oxy-ethyl] ester Formula: C15H29O6PS MolecularWeight: 368.425921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H29O6PS/c1-4-6-8-9-11-20-12-14(13-21-22(17,18)19-3)23-15(16)10-7-5-2/h7,10,14H,4-6,8-9,11-13H2,1-3H3,(H,17,18)/b10-7+/t14-/m1/s1