[4-oxidanylidene-2-(tetradecoxymethyl)pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite

Systemtic Name: [4-oxidanylidene-2-(tetradecoxymethyl)pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite Openeye Name: [4-oxo-2-(tetradecoxymethyl)pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite CAS Name: [4-oxo-2-(tetradecoxymethyl)pentyl] 4-(1-pyrrolidin-1-iumyl)butyl hydrogen phosphite IUPAC Name: [4-oxo-2-(tetradecoxymethyl)pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite Traditional Name: [4-keto-2-(myristyloxymethyl)pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite Formula: C28H57NO5P+ MolecularWeight: 518.729641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCCC[NH+]1CCCC1

Isomeric SMILES

CCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCCC[NH+]1CCCC1

InChI

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