8-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]octyl prop-2-enoate

Systemtic Name: 8-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]octyl prop-2-enoate Openeye Name: 8-[1-cyano-2-[4-[4-(1-methylheptoxy)phenyl]phenyl]cyclohexyl]octyl prop-2-enoate CAS Name: 2-propenoic acid 8-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]octyl ester IUPAC Name: 8-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]octyl prop-2-enoate Traditional Name: acrylic acid 8-[1-cyano-2-[4-[4-(1-methylheptoxy)phenyl]phenyl]cyclohexyl]octyl ester Formula: C38H53NO3 MolecularWeight: 571.83232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCCCC3(CCCCCCCCOC(=O)C=C)C#N

Isomeric SMILES

CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCCCC3(CCCCCCCCOC(=O)C=C)C#N

InChI

InChI=1S/C38H53NO3/c1-4-6-7-12-17-31(3)42-35-25-23-33(24-26-35)32-19-21-34(22-20-32)36-18-13-15-28-38(36,30-39)27-14-10-8-9-11-16-29-41-37(40)5-2/h5,19-26,31,36H,2,4,6-18,27-29H2,1,3H3