2-(2-oxidanylidenepropyl)icosyl 2-pyrrolidin-1-ylethyl hydrogen phosphate

Systemtic Name: 2-(2-oxidanylidenepropyl)icosyl 2-pyrrolidin-1-ylethyl hydrogen phosphate Openeye Name: 2-acetonylicosyl 2-pyrrolidin-1-ylethyl hydrogen phosphate CAS Name: 2-(2-oxopropyl)eicosyl 2-(1-pyrrolidinyl)ethyl hydrogen phosphate IUPAC Name: 2-(2-oxopropyl)icosyl 2-pyrrolidin-1-ylethyl hydrogen phosphate Traditional Name: 2-acetonyleicosyl 2-pyrrolidinoethyl hydrogen phosphate Formula: C29H58NO5P MolecularWeight: 531.748281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CC(=O)C)COP(=O)(O)OCCN1CCCC1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CC(=O)C)COP(=O)(O)OCCN1CCCC1

InChI

InChI=1S/C29H58NO5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29(26-28(2)31)27-35-36(32,33)34-25-24-30-22-19-20-23-30/h29H,3-27H2,1-2H3,(H,32,33)