methyl 4-(3-chloranyl-4-fluoranyl-phenyl)-4-cyano-3-phenyl-butanoate

Systemtic Name: methyl 4-(3-chloranyl-4-fluoranyl-phenyl)-4-cyano-3-phenyl-butanoate Openeye Name: methyl 4-(3-chloro-4-fluoro-phenyl)-4-cyano-3-phenyl-butanoate CAS Name: 4-(3-chloro-4-fluorophenyl)-4-cyano-3-phenylbutanoic acid methyl ester IUPAC Name: methyl 4-(3-chloro-4-fluorophenyl)-4-cyano-3-phenylbutanoate Traditional Name: 4-(3-chloro-4-fluoro-phenyl)-4-cyano-3-phenyl-butyric acid methyl ester Formula: C18H15ClFNO2 MolecularWeight: 331.768603

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)C(C#N)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)C(C#N)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C18H15ClFNO2/c1-23-18(22)10-14(12-5-3-2-4-6-12)15(11-21)13-7-8-17(20)16(19)9-13/h2-9,14-15H,10H2,1H3