[3-octadecoxy-2-(3-oxidanylidenebutanoyloxy)propyl] 4-pyrrolidin-1-ylbutyl phosphate

Systemtic Name: [3-octadecoxy-2-(3-oxidanylidenebutanoyloxy)propyl] 4-pyrrolidin-1-ylbutyl phosphate Openeye Name: [3-octadecoxy-2-(3-oxobutanoyloxy)propyl] 4-pyrrolidin-1-ylbutyl phosphate CAS Name: [2-(1,3-dioxobutoxy)-3-octadecoxypropyl] 4-(1-pyrrolidinyl)butyl phosphate IUPAC Name: [3-octadecoxy-2-(3-oxobutanoyloxy)propyl] 4-pyrrolidin-1-ylbutyl phosphate Traditional Name: (2-acetoacetyloxy-3-stearyloxy-propyl) 4-pyrrolidinobutyl phosphate Formula: C33H63NO8P- MolecularWeight: 632.828981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCCCCN1CCCC1)OC(=O)CC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCCCCN1CCCC1)OC(=O)CC(=O)C

InChI

InChI=1S/C33H64NO8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26-39-29-32(42-33(36)28-31(2)35)30-41-43(37,38)40-27-22-20-25-34-23-18-19-24-34/h32H,3-30H2,1-2H3,(H,37,38)/p-1