[4-(4-hexoxyphenyl)phenyl] 3-cyano-4-(4-pentylcyclohexyl)benzoate

Systemtic Name: [4-(4-hexoxyphenyl)phenyl] 3-cyano-4-(4-pentylcyclohexyl)benzoate Openeye Name: [4-(4-hexoxyphenyl)phenyl] 3-cyano-4-(4-pentylcyclohexyl)benzoate CAS Name: 3-cyano-4-(4-pentylcyclohexyl)benzoic acid [4-(4-hexoxyphenyl)phenyl] ester IUPAC Name: [4-(4-hexoxyphenyl)phenyl] 3-cyano-4-(4-pentylcyclohexyl)benzoate Traditional Name: 4-(4-amylcyclohexyl)-3-cyano-benzoic acid [4-(4-hexoxyphenyl)phenyl] ester Formula: C37H45NO3 MolecularWeight: 551.7581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCC)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCC)C#N

InChI

InChI=1S/C37H45NO3/c1-3-5-7-9-25-40-34-20-15-29(16-21-34)30-17-22-35(23-18-30)41-37(39)32-19-24-36(33(26-32)27-38)31-13-11-28(12-14-31)10-8-6-4-2/h15-24,26,28,31H,3-14,25H2,1-2H3