(4-pentoxyphenyl) 4-[4-(2-methylbutyl)cyclohexyl]cyclohexane-1-carboxylate

Systemtic Name: (4-pentoxyphenyl) 4-[4-(2-methylbutyl)cyclohexyl]cyclohexane-1-carboxylate Openeye Name: (4-pentoxyphenyl) 4-[4-(2-methylbutyl)cyclohexyl]cyclohexanecarboxylate CAS Name: 4-[4-(2-methylbutyl)cyclohexyl]-1-cyclohexanecarboxylic acid (4-pentoxyphenyl) ester IUPAC Name: (4-pentoxyphenyl) 4-[4-(2-methylbutyl)cyclohexyl]cyclohexane-1-carboxylate Traditional Name: 4-[4-(2-methylbutyl)cyclohexyl]cyclohexanecarboxylic acid (4-amoxyphenyl) ester Formula: C29H46O3 MolecularWeight: 442.67374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CC(C)CC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CC(C)CC

InChI

InChI=1S/C29H46O3/c1-4-6-7-20-31-27-16-18-28(19-17-27)32-29(30)26-14-12-25(13-15-26)24-10-8-23(9-11-24)21-22(3)5-2/h16-19,22-26H,4-15,20-21H2,1-3H3