[3-[2-(dimethylamino)-2-oxidanylidene-ethoxy]phenyl] 2-(octanoylamino)ethyl phosphate

Systemtic Name: [3-[2-(dimethylamino)-2-oxidanylidene-ethoxy]phenyl] 2-(octanoylamino)ethyl phosphate Openeye Name: [3-[2-(dimethylamino)-2-oxo-ethoxy]phenyl] 2-(octanoylamino)ethyl phosphate CAS Name: [3-[2-(dimethylamino)-2-oxoethoxy]phenyl] 2-(1-oxooctylamino)ethyl phosphate IUPAC Name: [3-[2-(dimethylamino)-2-oxoethoxy]phenyl] 2-(octanoylamino)ethyl phosphate Traditional Name: 2-(caprylylamino)ethyl [3-[2-(dimethylamino)-2-keto-ethoxy]phenyl] phosphate Formula: C20H32N2O7P- MolecularWeight: 443.451041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCCOP(=O)([O-])OC1=CC=CC(=C1)OCC(=O)N(C)C

Isomeric SMILES

CCCCCCCC(=O)NCCOP(=O)([O-])OC1=CC=CC(=C1)OCC(=O)N(C)C

InChI

InChI=1S/C20H33N2O7P/c1-4-5-6-7-8-12-19(23)21-13-14-28-30(25,26)29-18-11-9-10-17(15-18)27-16-20(24)22(2)3/h9-11,15H,4-8,12-14,16H2,1-3H3,(H,21,23)(H,25,26)/p-1