bis(2-isocyanoethyl) [2-(octanoylamino)-2-phenyl-ethyl] phosphite

Systemtic Name: bis(2-isocyanoethyl) [2-(octanoylamino)-2-phenyl-ethyl] phosphite Openeye Name: bis(2-isocyanoethyl) [2-(octanoylamino)-2-phenyl-ethyl] phosphite CAS Name: phosphorous acid bis(2-isocyanoethyl) [2-(1-oxooctylamino)-2-phenylethyl] ester IUPAC Name: bis(2-isocyanoethyl) [2-(octanoylamino)-2-phenylethyl] phosphite Traditional Name: phosphorous acid [2-(caprylylamino)-2-phenyl-ethyl] bis(2-isocyanoethyl) ester Formula: C22H32N3O4P MolecularWeight: 433.480941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(COP(OCC[N+]#[C-])OCC[N+]#[C-])C1=CC=CC=C1

Isomeric SMILES

CCCCCCCC(=O)NC(COP(OCC[N+]#[C-])OCC[N+]#[C-])C1=CC=CC=C1

InChI

InChI=1S/C22H32N3O4P/c1-4-5-6-7-11-14-22(26)25-21(20-12-9-8-10-13-20)19-29-30(27-17-15-23-2)28-18-16-24-3/h8-10,12-13,21H,4-7,11,14-19H2,1H3,(H,25,26)