[2-cyano-4-(2-ethylhexyl)phenyl] 1-(4-butylphenyl)cyclohexane-1-carboxylate

Systemtic Name: [2-cyano-4-(2-ethylhexyl)phenyl] 1-(4-butylphenyl)cyclohexane-1-carboxylate Openeye Name: [2-cyano-4-(2-ethylhexyl)phenyl] 1-(4-butylphenyl)cyclohexanecarboxylate CAS Name: 1-(4-butylphenyl)-1-cyclohexanecarboxylic acid [2-cyano-4-(2-ethylhexyl)phenyl] ester IUPAC Name: [2-cyano-4-(2-ethylhexyl)phenyl] 1-(4-butylphenyl)cyclohexane-1-carboxylate Traditional Name: 1-(4-butylphenyl)cyclohexanecarboxylic acid [2-cyano-4-(2-ethylhexyl)phenyl] ester Formula: C32H43NO2 MolecularWeight: 473.68932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)CC(CC)CCCC)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)CC(CC)CCCC)C#N

InChI

InChI=1S/C32H43NO2/c1-4-7-12-25(6-3)22-27-16-19-30(28(23-27)24-33)35-31(34)32(20-10-9-11-21-32)29-17-14-26(15-18-29)13-8-5-2/h14-19,23,25H,4-13,20-22H2,1-3H3