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

Systemtic Name: (2-cyano-4-decyl-phenyl) 1-(4-decylphenyl)cyclohexane-1-carboxylate Openeye Name: (2-cyano-4-decyl-phenyl) 1-(4-decylphenyl)cyclohexanecarboxylate CAS Name: 1-(4-decylphenyl)-1-cyclohexanecarboxylic acid (2-cyano-4-decylphenyl) ester IUPAC Name: (2-cyano-4-decylphenyl) 1-(4-decylphenyl)cyclohexane-1-carboxylate Traditional Name: 1-(4-decylphenyl)cyclohexanecarboxylic acid (2-cyano-4-decyl-phenyl) ester Formula: C40H59NO2 MolecularWeight: 585.90196

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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)CCCCCCCCCC)C#N

Isomeric SMILES

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

InChI

InChI=1S/C40H59NO2/c1-3-5-7-9-11-13-15-18-22-34-24-27-37(28-25-34)40(30-20-17-21-31-40)39(42)43-38-29-26-35(32-36(38)33-41)23-19-16-14-12-10-8-6-4-2/h24-29,32H,3-23,30-31H2,1-2H3