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(4-pentylphenyl) 4-(4-butyl-2-methyl-cyclohexyl)benzoate

(4-pentylphenyl) 4-(4-butyl-2-methyl-cyclohexyl)benzoate

Systemtic Name:(4-pentylphenyl) 4-(4-butyl-2-methyl-cyclohexyl)benzoate
Openeye Name:(4-pentylphenyl) 4-(4-butyl-2-methyl-cyclohexyl)benzoate
CAS Name:4-(4-butyl-2-methylcyclohexyl)benzoic acid (4-pentylphenyl) ester
IUPAC Name:(4-pentylphenyl) 4-(4-butyl-2-methylcyclohexyl)benzoate
Traditional Name:4-(4-butyl-2-methyl-cyclohexyl)benzoic acid (4-amylphenyl) ester
Formula: C29H40O2
MolecularWeight: 420.6267
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3C)CCCC


Isomeric SMILES

CCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3C)CCCC


InChI

InChI=1S/C29H40O2/c1-4-6-8-10-23-11-18-27(19-12-23)31-29(30)26-16-14-25(15-17-26)28-20-13-24(9-7-5-2)21-22(28)3/h11-12,14-19,22,24,28H,4-10,13,20-21H2,1-3H3


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