tert-butyl 4-(3,4-dimethylphenyl)hexanoate

Systemtic Name: tert-butyl 4-(3,4-dimethylphenyl)hexanoate Openeye Name: tert-butyl 4-(3,4-dimethylphenyl)hexanoate CAS Name: 4-(3,4-dimethylphenyl)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3,4-dimethylphenyl)hexanoate Traditional Name: 4-(3,4-dimethylphenyl)hexanoic acid tert-butyl ester Formula: C18H28O2 MolecularWeight: 276.41372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)OC(C)(C)C)C1=CC(=C(C=C1)C)C

Isomeric SMILES

CCC(CCC(=O)OC(C)(C)C)C1=CC(=C(C=C1)C)C

InChI

InChI=1S/C18H28O2/c1-7-15(10-11-17(19)20-18(4,5)6)16-9-8-13(2)14(3)12-16/h8-9,12,15H,7,10-11H2,1-6H3