(4-pentylphenyl) 4-[(E)-2-(4-pentylcyclohexyl)ethenyl]cyclohexane-1-carboxylate

Systemtic Name: (4-pentylphenyl) 4-[(E)-2-(4-pentylcyclohexyl)ethenyl]cyclohexane-1-carboxylate Openeye Name: (4-pentylphenyl) 4-[(E)-2-(4-pentylcyclohexyl)vinyl]cyclohexanecarboxylate CAS Name: 4-[(E)-2-(4-pentylcyclohexyl)ethenyl]-1-cyclohexanecarboxylic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) 4-[(E)-2-(4-pentylcyclohexyl)ethenyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-2-(4-amylcyclohexyl)vinyl]cyclohexanecarboxylic acid (4-amylphenyl) ester Formula: C31H48O2 MolecularWeight: 452.71162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C=CC2CCC(CC2)C(=O)OC3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCC1CCC(CC1)/C=C/C2CCC(CC2)C(=O)OC3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C31H48O2/c1-3-5-7-9-25-11-13-27(14-12-25)15-16-28-17-21-29(22-18-28)31(32)33-30-23-19-26(20-24-30)10-8-6-4-2/h15-16,19-20,23-25,27-29H,3-14,17-18,21-22H2,1-2H3/b16-15+