[2-methyl-4-(phenylcarbonyl)phenyl] 4-[4-(2-methylbutan-2-yl)phenoxy]butanoate

Systemtic Name: [2-methyl-4-(phenylcarbonyl)phenyl] 4-[4-(2-methylbutan-2-yl)phenoxy]butanoate Openeye Name: (4-benzoyl-2-methyl-phenyl) 4-[4-(1,1-dimethylpropyl)phenoxy]butanoate CAS Name: 4-[4-(2-methylbutan-2-yl)phenoxy]butanoic acid (4-benzoyl-2-methylphenyl) ester IUPAC Name: (4-benzoyl-2-methylphenyl) 4-[4-(2-methylbutan-2-yl)phenoxy]butanoate Traditional Name: 4-(4-tert-amylphenoxy)butyric acid (4-benzoyl-2-methyl-phenyl) ester Formula: C29H32O4 MolecularWeight: 444.56198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCCC(=O)OC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCCC(=O)OC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C29H32O4/c1-5-29(3,4)24-14-16-25(17-15-24)32-19-9-12-27(30)33-26-18-13-23(20-21(26)2)28(31)22-10-7-6-8-11-22/h6-8,10-11,13-18,20H,5,9,12,19H2,1-4H3