2-(azetidin-1-ium-1-yl)ethyl (3-octadecoxy-2-phenylmethoxy-propyl) hydrogen phosphite

Systemtic Name: 2-(azetidin-1-ium-1-yl)ethyl (3-octadecoxy-2-phenylmethoxy-propyl) hydrogen phosphite Openeye Name: 2-(azetidin-1-ium-1-yl)ethyl (2-benzyloxy-3-octadecoxy-propyl) hydrogen phosphite CAS Name: 2-(1-azetidin-1-iumyl)ethyl (3-octadecoxy-2-phenylmethoxypropyl) hydrogen phosphite IUPAC Name: 2-(azetidin-1-ium-1-yl)ethyl (3-octadecoxy-2-phenylmethoxypropyl) hydrogen phosphite Traditional Name: 2-(azetidin-1-ium-1-yl)ethyl (2-benzoxy-3-stearyloxy-propyl) hydrogen phosphite Formula: C33H61NO5P+ MolecularWeight: 582.814901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(O)OCC[NH+]1CCC1)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(O)OCC[NH+]1CCC1)OCC2=CC=CC=C2

InChI

InChI=1S/C33H60NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-27-36-30-33(37-29-32-22-18-17-19-23-32)31-39-40(35)38-28-26-34-24-21-25-34/h17-19,22-23,33,35H,2-16,20-21,24-31H2,1H3/p+1