(4-phenylmethoxyphenyl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate

Systemtic Name: (4-phenylmethoxyphenyl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate Openeye Name: (4-benzyloxyphenyl) 4-(4-chloro-3,5-dimethyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)butanoic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 4-(4-chloro-3,5-dimethylphenoxy)butanoate Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)butyric acid (4-benzoxyphenyl) ester Formula: C25H25ClO4 MolecularWeight: 424.9166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H25ClO4/c1-18-15-23(16-19(2)25(18)26)28-14-6-9-24(27)30-22-12-10-21(11-13-22)29-17-20-7-4-3-5-8-20/h3-5,7-8,10-13,15-16H,6,9,14,17H2,1-2H3