[4-oxidanylidene-2-(pentadecoxymethyl)pentyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite

Systemtic Name: [4-oxidanylidene-2-(pentadecoxymethyl)pentyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite Openeye Name: [4-oxo-2-(pentadecoxymethyl)pentyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite CAS Name: [4-oxo-2-(pentadecoxymethyl)pentyl] 3-(1-pyrrolidin-1-iumyl)propyl hydrogen phosphite IUPAC Name: [4-oxo-2-(pentadecoxymethyl)pentyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite Traditional Name: [4-keto-2-(pentadecoxymethyl)pentyl] 3-pyrrolidin-1-ium-1-ylpropyl hydrogen phosphite Formula: C28H57NO5P+ MolecularWeight: 518.729641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCC[NH+]1CCCC1

Isomeric SMILES

CCCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCC[NH+]1CCCC1

InChI

InChI=1S/C28H56NO5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-22-32-25-28(24-27(2)30)26-34-35(31)33-23-18-21-29-19-15-16-20-29/h28,31H,3-26H2,1-2H3/p+1