(4-butylphenyl) 4-(2-methyl-4-propyl-cyclohexyl)benzoate

Systemtic Name: (4-butylphenyl) 4-(2-methyl-4-propyl-cyclohexyl)benzoate Openeye Name: (4-butylphenyl) 4-(2-methyl-4-propyl-cyclohexyl)benzoate CAS Name: 4-(2-methyl-4-propylcyclohexyl)benzoic acid (4-butylphenyl) ester IUPAC Name: (4-butylphenyl) 4-(2-methyl-4-propylcyclohexyl)benzoate Traditional Name: 4-(2-methyl-4-propyl-cyclohexyl)benzoic acid (4-butylphenyl) ester Formula: C27H36O2 MolecularWeight: 392.57354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3C)CCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3C)CCC

InChI

InChI=1S/C27H36O2/c1-4-6-8-21-9-16-25(17-10-21)29-27(28)24-14-12-23(13-15-24)26-18-11-22(7-5-2)19-20(26)3/h9-10,12-17,20,22,26H,4-8,11,18-19H2,1-3H3