[2-(heptadecoxymethyl)-4-oxidanylidene-heptyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite

Systemtic Name: [2-(heptadecoxymethyl)-4-oxidanylidene-heptyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite Openeye Name: [2-(heptadecoxymethyl)-4-oxo-heptyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite CAS Name: [2-(heptadecoxymethyl)-4-oxoheptyl] 3-(1-pyrrolidin-1-iumyl)propyl hydrogen phosphite IUPAC Name: [2-(heptadecoxymethyl)-4-oxoheptyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite Traditional Name: [2-(heptadecoxymethyl)-4-keto-heptyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite Formula: C32H65NO5P+ MolecularWeight: 574.835961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOCC(CC(=O)CCC)COP(O)OCCC[NH+]1CCCC1

Isomeric SMILES

CCCCCCCCCCCCCCCCCOCC(CC(=O)CCC)COP(O)OCCC[NH+]1CCCC1

InChI

InChI=1S/C32H64NO5P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-26-36-29-31(28-32(34)22-4-2)30-38-39(35)37-27-21-25-33-23-18-19-24-33/h31,35H,3-30H2,1-2H3/p+1