7-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]heptyl 2-methylprop-2-enoate

Systemtic Name: 7-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]heptyl 2-methylprop-2-enoate Openeye Name: 7-[1-cyano-2-[4-[4-(1-methylheptoxy)phenyl]phenyl]cyclohexyl]heptyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 7-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]heptyl ester IUPAC Name: 7-[1-cyano-2-[4-(4-octan-2-yloxyphenyl)phenyl]cyclohexyl]heptyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 7-[1-cyano-2-[4-[4-(1-methylheptoxy)phenyl]phenyl]cyclohexyl]heptyl ester Formula: C38H53NO3 MolecularWeight: 571.83232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H53NO3/c1-5-6-7-11-16-31(4)42-35-24-22-33(23-25-35)32-18-20-34(21-19-32)36-17-12-14-27-38(36,29-39)26-13-9-8-10-15-28-41-37(40)30(2)3/h18-25,31,36H,2,5-17,26-28H2,1,3-4H3