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

Systemtic Name: methyl 4-(2-chloranyl-4-cyano-phenoxy)butanoate Openeye Name: methyl 4-(2-chloro-4-cyano-phenoxy)butanoate CAS Name: 4-(2-chloro-4-cyanophenoxy)butanoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-4-cyanophenoxy)butanoate Traditional Name: 4-(2-chloro-4-cyano-phenoxy)butyric acid methyl ester Formula: C12H12ClNO3 MolecularWeight: 253.68158

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=C(C=C(C=C1)C#N)Cl

Isomeric SMILES

COC(=O)CCCOC1=C(C=C(C=C1)C#N)Cl

InChI

InChI=1S/C12H12ClNO3/c1-16-12(15)3-2-6-17-11-5-4-9(8-14)7-10(11)13/h4-5,7H,2-3,6H2,1H3