(2-cyano-4-nonyl-phenyl) 1-(4-decylphenyl)cyclohexane-1-carboxylate

Systemtic Name: (2-cyano-4-nonyl-phenyl) 1-(4-decylphenyl)cyclohexane-1-carboxylate Openeye Name: (2-cyano-4-nonyl-phenyl) 1-(4-decylphenyl)cyclohexanecarboxylate CAS Name: 1-(4-decylphenyl)-1-cyclohexanecarboxylic acid (2-cyano-4-nonylphenyl) ester IUPAC Name: (2-cyano-4-nonylphenyl) 1-(4-decylphenyl)cyclohexane-1-carboxylate Traditional Name: 1-(4-decylphenyl)cyclohexanecarboxylic acid (2-cyano-4-nonyl-phenyl) ester Formula: C39H57NO2 MolecularWeight: 571.87538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)CCCCCCCCC)C#N

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)CCCCCCCCC)C#N

InChI

InChI=1S/C39H57NO2/c1-3-5-7-9-11-13-14-17-21-33-23-26-36(27-24-33)39(29-19-16-20-30-39)38(41)42-37-28-25-34(31-35(37)32-40)22-18-15-12-10-8-6-4-2/h23-28,31H,3-22,29-30H2,1-2H3