3-[4,8,11-tris(2-cyanoethyl)-1,4,8,11-tetrazoniacyclotetradec-1-yl]propanenitrile

Systemtic Name: 3-[4,8,11-tris(2-cyanoethyl)-1,4,8,11-tetrazoniacyclotetradec-1-yl]propanenitrile Openeye Name: 3-[4,8,11-tris(2-cyanoethyl)-1,4,8,11-tetrazoniacyclotetradec-1-yl]propanenitrile CAS Name: 3-[4,8,11-tris(2-cyanoethyl)-1,4,8,11-tetrazoniacyclotetradec-1-yl]propanenitrile IUPAC Name: 3-[4,8,11-tris(2-cyanoethyl)-1,4,8,11-tetrazoniacyclotetradec-1-yl]propanenitrile Traditional Name: 3-[4,8,11-tris(2-cyanoethyl)-1,4,8,11-tetrazoniacyclotetradec-1-yl]propionitrile Formula: C22H40N8+4 MolecularWeight: 416.6066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+](CCC[NH+](CC[NH+](C1)CCC#N)CCC#N)CCC#N)CCC#N

Isomeric SMILES

C1C[NH+](CC[NH+](CCC[NH+](CC[NH+](C1)CCC#N)CCC#N)CCC#N)CCC#N

InChI

InChI=1S/C22H36N8/c23-7-1-11-27-15-5-16-29(13-3-9-25)21-22-30(14-4-10-26)18-6-17-28(20-19-27)12-2-8-24/h1-6,11-22H2/p+4