methyl 4-(2-chloranyl-5-methyl-phenoxy)butanoate

Systemtic Name: methyl 4-(2-chloranyl-5-methyl-phenoxy)butanoate Openeye Name: methyl 4-(2-chloro-5-methyl-phenoxy)butanoate CAS Name: 4-(2-chloro-5-methylphenoxy)butanoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-5-methylphenoxy)butanoate Traditional Name: 4-(2-chloro-5-methyl-phenoxy)butyric acid methyl ester Formula: C12H15ClO3 MolecularWeight: 242.6987

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClO3/c1-9-5-6-10(13)11(8-9)16-7-3-4-12(14)15-2/h5-6,8H,3-4,7H2,1-2H3