[(4S,5R)-1-dimethoxyphosphoryl-4-(hexanoylamino)dodecan-5-yl] (phenylmethyl) carbonate

Systemtic Name: [(4S,5R)-1-dimethoxyphosphoryl-4-(hexanoylamino)dodecan-5-yl] (phenylmethyl) carbonate Openeye Name: benzyl [(1R)-1-[(1S)-4-dimethoxyphosphoryl-1-(hexanoylamino)butyl]octyl] carbonate CAS Name: carbonic acid [(4S,5R)-1-dimethoxyphosphoryl-4-(1-oxohexylamino)dodecan-5-yl] (phenylmethyl) ester IUPAC Name: benzyl [(4S,5R)-1-dimethoxyphosphoryl-4-(hexanoylamino)dodecan-5-yl] carbonate Traditional Name: carbonic acid benzyl [(1R)-1-[(1S)-1-(caproylamino)-4-dimethoxyphosphoryl-butyl]octyl] ester Formula: C28H48NO7P MolecularWeight: 541.656981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(CCCP(=O)(OC)OC)NC(=O)CCCCC)OC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC[C@H]([C@H](CCCP(=O)(OC)OC)NC(=O)CCCCC)OC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C28H48NO7P/c1-5-7-9-10-15-20-26(36-28(31)35-23-24-17-13-11-14-18-24)25(29-27(30)21-12-8-6-2)19-16-22-37(32,33-3)34-4/h11,13-14,17-18,25-26H,5-10,12,15-16,19-23H2,1-4H3,(H,29,30)/t25-,26+/m0/s1