4-(4-chloranyl-2-methyl-phenoxy)butanoic acid; ethyl ethanoate

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)butanoic acid; ethyl ethanoate Openeye Name: 4-(4-chloro-2-methyl-phenoxy)butanoic acid; ethyl acetate CAS Name: acetic acid ethyl ester; 4-(4-chloro-2-methylphenoxy)butanoic acid IUPAC Name: 4-(4-chloro-2-methylphenoxy)butanoic acid; ethyl acetate Traditional Name: acetic acid ethyl ester; 4-(4-chloro-2-methyl-phenoxy)butyric acid Formula: C15H21ClO5 MolecularWeight: 316.77724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C.CC1=C(C=CC(=C1)Cl)OCCCC(=O)O

Isomeric SMILES

CCOC(=O)C.CC1=C(C=CC(=C1)Cl)OCCCC(=O)O

InChI

InChI=1S/C11H13ClO3.C4H8O2/c1-8-7-9(12)4-5-10(8)15-6-2-3-11(13)14;1-3-6-4(2)5/h4-5,7H,2-3,6H2,1H3,(H,13,14);3H2,1-2H3