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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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