[1-[4-(dimethylamino)butoxy-oxidanyl-phosphanyl]oxy-3-(2-hexadecylphenoxy)propan-2-yl] ethanoate

Systemtic Name: [1-[4-(dimethylamino)butoxy-oxidanyl-phosphanyl]oxy-3-(2-hexadecylphenoxy)propan-2-yl] ethanoate Openeye Name: [1-[[4-(dimethylamino)butoxy-hydroxy-phosphanyl]oxymethyl]-2-(2-hexadecylphenoxy)ethyl] acetate CAS Name: acetic acid [1-[4-(dimethylamino)butoxy-hydroxyphosphino]oxy-3-(2-hexadecylphenoxy)propan-2-yl] ester IUPAC Name: [1-[4-(dimethylamino)butoxy-hydroxyphosphanyl]oxy-3-(2-hexadecylphenoxy)propan-2-yl] acetate Traditional Name: acetic acid [1-[(2-cetylphenoxy)methyl]-2-[4-(dimethylamino)butoxy-hydroxy-phosphino]oxy-ethyl] ester Formula: C33H60NO6P MolecularWeight: 597.806361

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCCCCN(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC=CC=C1OCC(COP(O)OCCCCN(C)C)OC(=O)C

InChI

InChI=1S/C33H60NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-31-24-19-20-25-33(31)37-28-32(40-30(2)35)29-39-41(36)38-27-22-21-26-34(3)4/h19-20,24-25,32,36H,5-18,21-23,26-29H2,1-4H3