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

Systemtic Name: [1-[3-(dimethylamino)propoxy-oxidanyl-phosphanyl]oxy-3-(4-dodecylphenoxy)propan-2-yl] ethanoate Openeye Name: [1-[[3-(dimethylamino)propoxy-hydroxy-phosphanyl]oxymethyl]-2-(4-dodecylphenoxy)ethyl] acetate CAS Name: acetic acid [1-[3-(dimethylamino)propoxy-hydroxyphosphino]oxy-3-(4-dodecylphenoxy)propan-2-yl] ester IUPAC Name: [1-[3-(dimethylamino)propoxy-hydroxyphosphanyl]oxy-3-(4-dodecylphenoxy)propan-2-yl] acetate Traditional Name: acetic acid [1-[[3-(dimethylamino)propoxy-hydroxy-phosphino]oxymethyl]-2-(4-laurylphenoxy)ethyl] ester Formula: C28H50NO6P MolecularWeight: 527.673461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(O)OCCCN(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)OCC(COP(O)OCCCN(C)C)OC(=O)C

InChI

InChI=1S/C28H50NO6P/c1-5-6-7-8-9-10-11-12-13-14-16-26-17-19-27(20-18-26)32-23-28(35-25(2)30)24-34-36(31)33-22-15-21-29(3)4/h17-20,28,31H,5-16,21-24H2,1-4H3