methyl 4-(2,5-dimethylphenoxy)butanoate

Systemtic Name: methyl 4-(2,5-dimethylphenoxy)butanoate Openeye Name: methyl 4-(2,5-dimethylphenoxy)butanoate CAS Name: 4-(2,5-dimethylphenoxy)butanoic acid methyl ester IUPAC Name: methyl 4-(2,5-dimethylphenoxy)butanoate Traditional Name: 4-(2,5-dimethylphenoxy)butyric acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCC(=O)OC

InChI

InChI=1S/C13H18O3/c1-10-6-7-11(2)12(9-10)16-8-4-5-13(14)15-3/h6-7,9H,4-5,8H2,1-3H3