(3-chlorophenyl) 4-[4-(2-methylbutan-2-yl)phenoxy]butanoate

Systemtic Name: (3-chlorophenyl) 4-[4-(2-methylbutan-2-yl)phenoxy]butanoate Openeye Name: (3-chlorophenyl) 4-[4-(1,1-dimethylpropyl)phenoxy]butanoate CAS Name: 4-[4-(2-methylbutan-2-yl)phenoxy]butanoic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) 4-[4-(2-methylbutan-2-yl)phenoxy]butanoate Traditional Name: 4-(4-tert-amylphenoxy)butyric acid (3-chlorophenyl) ester Formula: C21H25ClO3 MolecularWeight: 360.8744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClO3/c1-4-21(2,3)16-10-12-18(13-11-16)24-14-6-9-20(23)25-19-8-5-7-17(22)15-19/h5,7-8,10-13,15H,4,6,9,14H2,1-3H3