2-azanylethyl 2,5-bis(tetradecanoylamino)tetradecyl prop-2-enyl phosphate

Systemtic Name: 2-azanylethyl 2,5-bis(tetradecanoylamino)tetradecyl prop-2-enyl phosphate Openeye Name: allyl 2-aminoethyl 2,5-bis(tetradecanoylamino)tetradecyl phosphate CAS Name: phosphoric acid 2-aminoethyl 2,5-bis(1-oxotetradecylamino)tetradecyl prop-2-enyl ester IUPAC Name: 2-aminoethyl 2,5-bis(tetradecanoylamino)tetradecyl prop-2-enyl phosphate Traditional Name: phosphoric acid allyl 2-aminoethyl 2,5-bis(tetradecanoylamino)tetradecyl ester Formula: C47H94N3O6P MolecularWeight: 828.239521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC(CCCCCCCCC)CCC(COP(=O)(OCCN)OCC=C)NC(=O)CCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC(CCCCCCCCC)CCC(COP(=O)(OCCN)OCC=C)NC(=O)CCCCCCCCCCCCC

InChI

InChI=1S/C47H94N3O6P/c1-5-9-12-15-18-20-22-24-27-30-33-36-46(51)49-44(35-32-29-26-17-14-11-7-3)38-39-45(43-56-57(53,54-41-8-4)55-42-40-48)50-47(52)37-34-31-28-25-23-21-19-16-13-10-6-2/h8,44-45H,4-7,9-43,48H2,1-3H3,(H,49,51)(H,50,52)