[(2R)-2-hexanoyloxy-3-[methoxy(phenoxy)phosphoryl]oxy-propyl] hexanoate

Systemtic Name: [(2R)-2-hexanoyloxy-3-[methoxy(phenoxy)phosphoryl]oxy-propyl] hexanoate Openeye Name: [(2R)-2-hexanoyloxy-3-[methoxy(phenoxy)phosphoryl]oxy-propyl] hexanoate CAS Name: hexanoic acid [(2R)-3-[methoxy(phenoxy)phosphoryl]oxy-2-(1-oxohexoxy)propyl] ester IUPAC Name: [(2R)-2-hexanoyloxy-3-[methoxy(phenoxy)phosphoryl]oxypropyl] hexanoate Traditional Name: hexanoic acid [(2R)-2-caproyloxy-3-[methoxy(phenoxy)phosphoryl]oxy-propyl] ester Formula: C22H35O8P MolecularWeight: 458.482261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC(COP(=O)(OC)OC1=CC=CC=C1)OC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)OC[C@H](COP(=O)(OC)OC1=CC=CC=C1)OC(=O)CCCCC

InChI

InChI=1S/C22H35O8P/c1-4-6-9-15-21(23)27-17-20(29-22(24)16-10-7-5-2)18-28-31(25,26-3)30-19-13-11-8-12-14-19/h8,11-14,20H,4-7,9-10,15-18H2,1-3H3/t20-,31?/m1/s1