[5-(4-dodecoxyphenyl)-1-[2-(methylamino)ethoxy-oxidanyl-phosphanyl]oxy-pentan-2-yl] ethanoate

Systemtic Name: [5-(4-dodecoxyphenyl)-1-[2-(methylamino)ethoxy-oxidanyl-phosphanyl]oxy-pentan-2-yl] ethanoate Openeye Name: [4-(4-dodecoxyphenyl)-1-[[hydroxy-[2-(methylamino)ethoxy]phosphanyl]oxymethyl]butyl] acetate CAS Name: acetic acid [5-(4-dodecoxyphenyl)-1-[hydroxy-[2-(methylamino)ethoxy]phosphino]oxypentan-2-yl] ester IUPAC Name: [5-(4-dodecoxyphenyl)-1-[hydroxy-[2-(methylamino)ethoxy]phosphanyl]oxypentan-2-yl] acetate Traditional Name: acetic acid [1-[[hydroxy-[2-(methylamino)ethoxy]phosphino]oxymethyl]-4-(4-lauryloxyphenyl)butyl] ester Formula: C28H50NO6P MolecularWeight: 527.673461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)CCCC(COP(O)OCCNC)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)CCCC(COP(O)OCCNC)OC(=O)C

InChI

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