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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C68H129N/c1-7-13-19-25-31-34-40-44-51-62(50-43-37-28-22-16-10-4)58-66-61-65(56-49-57-69)67(59-63(52-45-38-29-23-17-11-5)53-47-41-35-32-26-20-14-8-2)68(66)60-64(54-46-39-30-24-18-12-6)55-48-42-36-33-27-21-15-9-3/h62-64H,7-56,58-61H2,1-6H3