3-[4,7,10-tris(2-cyanoethyl)-1,4,7,10-tetrazacyclotridec-1-yl]propanenitrile

Systemtic Name: 3-[4,7,10-tris(2-cyanoethyl)-1,4,7,10-tetrazacyclotridec-1-yl]propanenitrile Openeye Name: 3-[4,7,10-tris(2-cyanoethyl)-1,4,7,10-tetrazacyclotridec-1-yl]propanenitrile CAS Name: 3-[4,7,10-tris(2-cyanoethyl)-1,4,7,10-tetrazacyclotridec-1-yl]propanenitrile IUPAC Name: 3-[4,7,10-tris(2-cyanoethyl)-1,4,7,10-tetrazacyclotridec-1-yl]propanenitrile Traditional Name: 3-[4,7,10-tris(2-cyanoethyl)-1,4,7,10-tetrazacyclotridec-1-yl]propionitrile Formula: C21H34N8 MolecularWeight: 398.54826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(CCN(CCN(C1)CCC#N)CCC#N)CCC#N)CCC#N

Isomeric SMILES

C1CN(CCN(CCN(CCN(C1)CCC#N)CCC#N)CCC#N)CCC#N

InChI

InChI=1S/C21H34N8/c22-6-1-10-26-14-5-15-27(11-2-7-23)17-19-29(13-4-9-25)21-20-28(18-16-26)12-3-8-24/h1-5,10-21H2