2-(2-oxidanylidenepentyl)octadecyl 4-pyrrolidin-1-ylbutyl hydrogen phosphate

Systemtic Name: 2-(2-oxidanylidenepentyl)octadecyl 4-pyrrolidin-1-ylbutyl hydrogen phosphate Openeye Name: 2-(2-oxopentyl)octadecyl 4-pyrrolidin-1-ylbutyl hydrogen phosphate CAS Name: 2-(2-oxopentyl)octadecyl 4-(1-pyrrolidinyl)butyl hydrogen phosphate IUPAC Name: 2-(2-oxopentyl)octadecyl 4-pyrrolidin-1-ylbutyl hydrogen phosphate Traditional Name: 2-(2-ketopentyl)octadecyl 4-pyrrolidinobutyl hydrogen phosphate Formula: C31H62NO5P MolecularWeight: 559.801441

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCCCN1CCCC1

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)CCC)COP(=O)(O)OCCCCN1CCCC1

InChI

InChI=1S/C31H62NO5P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-23-30(28-31(33)22-4-2)29-37-38(34,35)36-27-21-20-26-32-24-18-19-25-32/h30H,3-29H2,1-2H3,(H,34,35)