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

Systemtic Name: [2-(octadecoxymethyl)-4-oxidanylidene-pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite Openeye Name: [2-(octadecoxymethyl)-4-oxo-pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite CAS Name: [2-(octadecoxymethyl)-4-oxopentyl] 4-(1-pyrrolidin-1-iumyl)butyl hydrogen phosphite IUPAC Name: [2-(octadecoxymethyl)-4-oxopentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite Traditional Name: [4-keto-2-(stearyloxymethyl)pentyl] 4-pyrrolidin-1-ium-1-ylbutyl hydrogen phosphite Formula: C32H65NO5P+ MolecularWeight: 574.835961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H64NO5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26-36-29-32(28-31(2)34)30-38-39(35)37-27-22-20-25-33-23-18-19-24-33/h32,35H,3-30H2,1-2H3/p+1