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

Systemtic Name: (4-butanoyloxyphenyl) 4-[4-(2-methylbutyl)cyclohexyl]cyclohexane-1-carboxylate Openeye Name: (4-butanoyloxyphenyl) 4-[4-(2-methylbutyl)cyclohexyl]cyclohexanecarboxylate CAS Name: 4-[4-(2-methylbutyl)cyclohexyl]-1-cyclohexanecarboxylic acid [4-(1-oxobutoxy)phenyl] ester IUPAC Name: (4-butanoyloxyphenyl) 4-[4-(2-methylbutyl)cyclohexyl]cyclohexane-1-carboxylate Traditional Name: 4-[4-(2-methylbutyl)cyclohexyl]cyclohexanecarboxylic acid (4-butyryloxyphenyl) ester Formula: C28H42O4 MolecularWeight: 442.63068

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CC(C)CC

Isomeric SMILES

CCCC(=O)OC1=CC=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CC(C)CC

InChI

InChI=1S/C28H42O4/c1-4-6-27(29)31-25-15-17-26(18-16-25)32-28(30)24-13-11-23(12-14-24)22-9-7-21(8-10-22)19-20(3)5-2/h15-18,20-24H,4-14,19H2,1-3H3