(4-propan-2-ylphenyl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate

Systemtic Name: (4-propan-2-ylphenyl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate Openeye Name: (4-isopropylphenyl) 4-(4-chloro-3,5-dimethyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)butanoic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) 4-(4-chloro-3,5-dimethylphenoxy)butanoate Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)butyric acid p-cumenyl ester Formula: C21H25ClO3 MolecularWeight: 360.8744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H25ClO3/c1-14(2)17-7-9-18(10-8-17)25-20(23)6-5-11-24-19-12-15(3)21(22)16(4)13-19/h7-10,12-14H,5-6,11H2,1-4H3