(2-ethoxy-3-hexadecoxy-propyl) [3-[(3-methyl-2H-imidazol-1-yl)methyl]phenyl] hydrogen phosphate

Systemtic Name: (2-ethoxy-3-hexadecoxy-propyl) [3-[(3-methyl-2H-imidazol-1-yl)methyl]phenyl] hydrogen phosphate Openeye Name: (2-ethoxy-3-hexadecoxy-propyl) [3-[(3-methyl-2H-imidazol-1-yl)methyl]phenyl] hydrogen phosphate CAS Name: (2-ethoxy-3-hexadecoxypropyl) [3-[(3-methyl-2H-imidazol-1-yl)methyl]phenyl] hydrogen phosphate IUPAC Name: (2-ethoxy-3-hexadecoxypropyl) [3-[(3-methyl-2H-imidazol-1-yl)methyl]phenyl] hydrogen phosphate Traditional Name: (3-cetyloxy-2-ethoxy-propyl) [3-[(3-methyl-4-imidazolin-1-yl)methyl]phenyl] hydrogen phosphate Formula: C32H57N2O6P MolecularWeight: 596.778541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COP(=O)(O)OC1=CC=CC(=C1)CN2CN(C=C2)C)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COP(=O)(O)OC1=CC=CC(=C1)CN2CN(C=C2)C)OCC

InChI

InChI=1S/C32H57N2O6P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-24-37-27-32(38-5-2)28-39-41(35,36)40-31-21-19-20-30(25-31)26-34-23-22-33(3)29-34/h19-23,25,32H,4-18,24,26-29H2,1-3H3,(H,35,36)