[6-diphenoxyphosphoryl-6-(phenylmethoxycarbonylamino)hexyl]azanium chloride

Systemtic Name: [6-diphenoxyphosphoryl-6-(phenylmethoxycarbonylamino)hexyl]azanium chloride Openeye Name: [6-(benzyloxycarbonylamino)-6-diphenoxyphosphoryl-hexyl]ammonium chloride CAS Name: [6-diphenoxyphosphoryl-6-(phenylmethoxycarbonylamino)hexyl]ammonium chloride IUPAC Name: [6-diphenoxyphosphoryl-6-(phenylmethoxycarbonylamino)hexyl]azanium chloride Traditional Name: [6-(benzyloxycarbonylamino)-6-diphenoxyphosphoryl-hexyl]ammonium chloride Formula: C26H32ClN2O5P MolecularWeight: 518.969441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCC[NH3+])P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCCC[NH3+])P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C26H31N2O5P.ClH/c27-20-12-4-11-19-25(28-26(29)31-21-22-13-5-1-6-14-22)34(30,32-23-15-7-2-8-16-23)33-24-17-9-3-10-18-24;/h1-3,5-10,13-18,25H,4,11-12,19-21,27H2,(H,28,29);1H