tris(2-cyanoethyl)-[(3,5-dicyanophenyl)methyl]phosphanium bromide

Systemtic Name: tris(2-cyanoethyl)-[(3,5-dicyanophenyl)methyl]phosphanium bromide Openeye Name: tris(2-cyanoethyl)-[(3,5-dicyanophenyl)methyl]phosphonium bromide CAS Name: tris(2-cyanoethyl)-[(3,5-dicyanophenyl)methyl]phosphonium bromide IUPAC Name: tris(2-cyanoethyl)-[(3,5-dicyanophenyl)methyl]phosphanium bromide Traditional Name: tris(2-cyanoethyl)-(3,5-dicyanobenzyl)phosphonium bromide Formula: C18H17BrN5P MolecularWeight: 414.238841

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C#N)C#N)C[P+](CCC#N)(CCC#N)CCC#N.[Br-]

Isomeric SMILES

C1=C(C=C(C=C1C#N)C#N)C[P+](CCC#N)(CCC#N)CCC#N.[Br-]

InChI

InChI=1S/C18H17N5P.BrH/c19-4-1-7-24(8-2-5-20,9-3-6-21)15-18-11-16(13-22)10-17(12-18)14-23;/h10-12H,1-3,7-9,15H2;1H/q+1;/p-1