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

Systemtic Name: (4-pentylcyclohexyl) 4-(2-methyl-4-propyl-cyclohexyl)benzoate Openeye Name: (4-pentylcyclohexyl) 4-(2-methyl-4-propyl-cyclohexyl)benzoate CAS Name: 4-(2-methyl-4-propylcyclohexyl)benzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 4-(2-methyl-4-propylcyclohexyl)benzoate Traditional Name: 4-(2-methyl-4-propyl-cyclohexyl)benzoic acid (4-amylcyclohexyl) ester Formula: C28H44O2 MolecularWeight: 412.64776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3C)CCC

Isomeric SMILES

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3C)CCC

InChI

InChI=1S/C28H44O2/c1-4-6-7-9-22-10-17-26(18-11-22)30-28(29)25-15-13-24(14-16-25)27-19-12-23(8-5-2)20-21(27)3/h13-16,21-23,26-27H,4-12,17-20H2,1-3H3