ethyl 4-chloranyl-4-(3-cyano-4-cyclohexyl-phenyl)butanoate

Systemtic Name: ethyl 4-chloranyl-4-(3-cyano-4-cyclohexyl-phenyl)butanoate Openeye Name: ethyl 4-chloro-4-(3-cyano-4-cyclohexyl-phenyl)butanoate CAS Name: 4-chloro-4-(3-cyano-4-cyclohexylphenyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-chloro-4-(3-cyano-4-cyclohexylphenyl)butanoate Traditional Name: 4-chloro-4-(3-cyano-4-cyclohexyl-phenyl)butyric acid ethyl ester Formula: C19H24ClNO2 MolecularWeight: 333.85236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C1=CC(=C(C=C1)C2CCCCC2)C#N)Cl

Isomeric SMILES

CCOC(=O)CCC(C1=CC(=C(C=C1)C2CCCCC2)C#N)Cl

InChI

InChI=1S/C19H24ClNO2/c1-2-23-19(22)11-10-18(20)15-8-9-17(16(12-15)13-21)14-6-4-3-5-7-14/h8-9,12,14,18H,2-7,10-11H2,1H3