4-(2-azanyl-2-diphenoxyphosphoryl-ethyl)benzenecarbonitrile hydrobromide

Systemtic Name: 4-(2-azanyl-2-diphenoxyphosphoryl-ethyl)benzenecarbonitrile hydrobromide Openeye Name: 4-(2-amino-2-diphenoxyphosphoryl-ethyl)benzonitrile hydrobromide CAS Name: 4-(2-amino-2-diphenoxyphosphorylethyl)benzonitrile hydrobromide IUPAC Name: 4-(2-amino-2-diphenoxyphosphorylethyl)benzonitrile hydrobromide Traditional Name: 4-(2-amino-2-diphenoxyphosphoryl-ethyl)benzonitrile hydrobromide Formula: C21H20BrN2O3P MolecularWeight: 459.272861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(C(CC2=CC=C(C=C2)C#N)N)OC3=CC=CC=C3.Br

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(C(CC2=CC=C(C=C2)C#N)N)OC3=CC=CC=C3.Br

InChI

InChI=1S/C21H19N2O3P.BrH/c22-16-18-13-11-17(12-14-18)15-21(23)27(24,25-19-7-3-1-4-8-19)26-20-9-5-2-6-10-20;/h1-14,21H,15,23H2;1H