9-[1-cyano-2-[4-[4-(2-methylbutoxy)phenyl]phenyl]cyclohexyl]nonyl prop-2-enoate

Systemtic Name: 9-[1-cyano-2-[4-[4-(2-methylbutoxy)phenyl]phenyl]cyclohexyl]nonyl prop-2-enoate Openeye Name: 9-[1-cyano-2-[4-[4-(2-methylbutoxy)phenyl]phenyl]cyclohexyl]nonyl prop-2-enoate CAS Name: 2-propenoic acid 9-[1-cyano-2-[4-[4-(2-methylbutoxy)phenyl]phenyl]cyclohexyl]nonyl ester IUPAC Name: 9-[1-cyano-2-[4-[4-(2-methylbutoxy)phenyl]phenyl]cyclohexyl]nonyl prop-2-enoate Traditional Name: acrylic acid 9-[1-cyano-2-[4-[4-(2-methylbutoxy)phenyl]phenyl]cyclohexyl]nonyl ester Formula: C36H49NO3 MolecularWeight: 543.77916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCCCC3(CCCCCCCCCOC(=O)C=C)C#N

Isomeric SMILES

CCC(C)COC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCCCC3(CCCCCCCCCOC(=O)C=C)C#N

InChI

InChI=1S/C36H49NO3/c1-4-29(3)27-40-33-22-20-31(21-23-33)30-16-18-32(19-17-30)34-15-11-13-25-36(34,28-37)24-12-9-7-6-8-10-14-26-39-35(38)5-2/h5,16-23,29,34H,2,4,6-15,24-27H2,1,3H3