2-[4-(dimethylamino)-3-oxidanylidene-4H-pyridin-1-ium-1-yl]ethyl (2-ethoxy-3-hexadecoxy-propyl) hydrogen phosphite

Systemtic Name: 2-[4-(dimethylamino)-3-oxidanylidene-4H-pyridin-1-ium-1-yl]ethyl (2-ethoxy-3-hexadecoxy-propyl) hydrogen phosphite Openeye Name: 2-[4-(dimethylamino)-3-oxo-4H-pyridin-1-ium-1-yl]ethyl (2-ethoxy-3-hexadecoxy-propyl) hydrogen phosphite CAS Name: 2-[4-(dimethylamino)-3-oxo-4H-pyridin-1-ium-1-yl]ethyl (2-ethoxy-3-hexadecoxypropyl) hydrogen phosphite IUPAC Name: 2-[4-(dimethylamino)-3-oxo-4H-pyridin-1-ium-1-yl]ethyl (2-ethoxy-3-hexadecoxypropyl) hydrogen phosphite Traditional Name: (3-cetyloxy-2-ethoxy-propyl) 2-[4-(dimethylamino)-3-keto-4H-pyridin-1-ium-1-yl]ethyl hydrogen phosphite Formula: C30H58N2O6P+ MolecularWeight: 573.765081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COP(O)OCC[N+]1=CC(=O)C(C=C1)N(C)C)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COP(O)OCC[N+]1=CC(=O)C(C=C1)N(C)C)OCC

InChI

InChI=1S/C30H58N2O6P/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23-35-26-28(36-6-2)27-38-39(34)37-24-22-32-21-20-29(31(3)4)30(33)25-32/h20-21,25,28-29,34H,5-19,22-24,26-27H2,1-4H3/q+1