(5-methyl-2-propan-2-yl-cyclohexyl) 4-(4-decoxyphenyl)benzoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 4-(4-decoxyphenyl)benzoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 4-(4-decoxyphenyl)benzoate CAS Name: 4-(4-decoxyphenyl)benzoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 4-(4-decoxyphenyl)benzoate Traditional Name: 4-(4-decoxyphenyl)benzoic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C33H48O3 MolecularWeight: 492.73242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3CC(CCC3C(C)C)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3CC(CCC3C(C)C)C

InChI

InChI=1S/C33H48O3/c1-5-6-7-8-9-10-11-12-23-35-30-20-18-28(19-21-30)27-14-16-29(17-15-27)33(34)36-32-24-26(4)13-22-31(32)25(2)3/h14-21,25-26,31-32H,5-13,22-24H2,1-4H3