2-[2,3,4-tris(2-octyldodecyl)cyclopenta-1,3-dien-1-yl]propanenitrile

Systemtic Name: 2-[2,3,4-tris(2-octyldodecyl)cyclopenta-1,3-dien-1-yl]propanenitrile Openeye Name: 2-[2,3,4-tris(2-octyldodecyl)cyclopenta-1,3-dien-1-yl]propanenitrile CAS Name: 2-[2,3,4-tris(2-octyldodecyl)-1-cyclopenta-1,3-dienyl]propanenitrile IUPAC Name: 2-[2,3,4-tris(2-octyldodecyl)cyclopenta-1,3-dien-1-yl]propanenitrile Traditional Name: 2-[2,3,4-tris(2-octyldodecyl)cyclopenta-1,3-dien-1-yl]propionitrile Formula: C68H129N MolecularWeight: 960.75856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCC)CC1=C(C(=C(C1)C(C)C#N)CC(CCCCCCCC)CCCCCCCCCC)CC(CCCCCCCC)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCC)CC1=C(C(=C(C1)C(C)C#N)CC(CCCCCCCC)CCCCCCCCCC)CC(CCCCCCCC)CCCCCCCCCC

InChI

InChI=1S/C68H129N/c1-8-14-20-26-32-35-41-45-51-62(50-44-38-29-23-17-11-4)56-65-59-66(61(7)60-69)68(58-64(54-47-40-31-25-19-13-6)55-49-43-37-34-28-22-16-10-3)67(65)57-63(52-46-39-30-24-18-12-5)53-48-42-36-33-27-21-15-9-2/h61-64H,8-59H2,1-7H3