[1-(4-dodecoxyphenyl)-3-[3-(methylamino)propoxy-oxidanyl-phosphanyl]oxy-propan-2-yl] propanoate

Systemtic Name: [1-(4-dodecoxyphenyl)-3-[3-(methylamino)propoxy-oxidanyl-phosphanyl]oxy-propan-2-yl] propanoate Openeye Name: [1-[(4-dodecoxyphenyl)methyl]-2-[hydroxy-[3-(methylamino)propoxy]phosphanyl]oxy-ethyl] propanoate CAS Name: propanoic acid [1-(4-dodecoxyphenyl)-3-[hydroxy-[3-(methylamino)propoxy]phosphino]oxypropan-2-yl] ester IUPAC Name: [1-(4-dodecoxyphenyl)-3-[hydroxy-[3-(methylamino)propoxy]phosphanyl]oxypropan-2-yl] propanoate Traditional Name: propionic acid [1-[[hydroxy-[3-(methylamino)propoxy]phosphino]oxymethyl]-2-(4-lauryloxyphenyl)ethyl] ester Formula: C28H50NO6P MolecularWeight: 527.673461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)CC(COP(O)OCCCNC)OC(=O)CC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)CC(COP(O)OCCCNC)OC(=O)CC

InChI

InChI=1S/C28H50NO6P/c1-4-6-7-8-9-10-11-12-13-14-21-32-26-18-16-25(17-19-26)23-27(35-28(30)5-2)24-34-36(31)33-22-15-20-29-3/h16-19,27,29,31H,4-15,20-24H2,1-3H3