[1-[2-dimethylaminoethyloxy(oxidanyl)phosphanyl]oxy-3-(3-tridecylphenoxy)propan-2-yl] methanoate

Systemtic Name: [1-[2-dimethylaminoethyloxy(oxidanyl)phosphanyl]oxy-3-(3-tridecylphenoxy)propan-2-yl] methanoate Openeye Name: [1-[[2-dimethylaminoethyloxy(hydroxy)phosphanyl]oxymethyl]-2-(3-tridecylphenoxy)ethyl] formate CAS Name: formic acid [1-[2-dimethylaminoethyloxy(hydroxy)phosphino]oxy-3-(3-tridecylphenoxy)propan-2-yl] ester IUPAC Name: [1-[2-dimethylaminoethyloxy(hydroxy)phosphanyl]oxy-3-(3-tridecylphenoxy)propan-2-yl] formate Traditional Name: formic acid [1-[[2-dimethylaminoethyloxy(hydroxy)phosphino]oxymethyl]-2-(3-tridecylphenoxy)ethyl] ester Formula: C27H48NO6P MolecularWeight: 513.646881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(O)OCCN(C)C)OC=O

Isomeric SMILES

CCCCCCCCCCCCCC1=CC(=CC=C1)OCC(COP(O)OCCN(C)C)OC=O

InChI

InChI=1S/C27H48NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-16-25-17-15-18-26(21-25)31-22-27(32-24-29)23-34-35(30)33-20-19-28(2)3/h15,17-18,21,24,27,30H,4-14,16,19-20,22-23H2,1-3H3