(4-butoxyphenyl) 4-(2-methyl-4-pentyl-cyclohexyl)benzoate

Systemtic Name: (4-butoxyphenyl) 4-(2-methyl-4-pentyl-cyclohexyl)benzoate Openeye Name: (4-butoxyphenyl) 4-(2-methyl-4-pentyl-cyclohexyl)benzoate CAS Name: 4-(2-methyl-4-pentylcyclohexyl)benzoic acid (4-butoxyphenyl) ester IUPAC Name: (4-butoxyphenyl) 4-(2-methyl-4-pentylcyclohexyl)benzoate Traditional Name: 4-(4-amyl-2-methyl-cyclohexyl)benzoic acid (4-butoxyphenyl) ester Formula: C29H40O3 MolecularWeight: 436.6261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(C(C1)C)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCC1CCC(C(C1)C)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C29H40O3/c1-4-6-8-9-23-10-19-28(22(3)21-23)24-11-13-25(14-12-24)29(30)32-27-17-15-26(16-18-27)31-20-7-5-2/h11-18,22-23,28H,4-10,19-21H2,1-3H3