ethyl 3-(2-chloranyl-5-cyano-3,4-dimethyl-phenyl)propanoate

Systemtic Name: ethyl 3-(2-chloranyl-5-cyano-3,4-dimethyl-phenyl)propanoate Openeye Name: ethyl 3-(2-chloro-5-cyano-3,4-dimethyl-phenyl)propanoate CAS Name: 3-(2-chloro-5-cyano-3,4-dimethylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-chloro-5-cyano-3,4-dimethylphenyl)propanoate Traditional Name: 3-(2-chloro-5-cyano-3,4-dimethyl-phenyl)propionic acid ethyl ester Formula: C14H16ClNO2 MolecularWeight: 265.73534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C(=C(C(=C1)C#N)C)C)Cl

Isomeric SMILES

CCOC(=O)CCC1=C(C(=C(C(=C1)C#N)C)C)Cl

InChI

InChI=1S/C14H16ClNO2/c1-4-18-13(17)6-5-11-7-12(8-16)9(2)10(3)14(11)15/h7H,4-6H2,1-3H3