3-(3-chlorophenyl)-4-cyano-4-(4-fluorophenyl)butanoic acid

Systemtic Name: 3-(3-chlorophenyl)-4-cyano-4-(4-fluorophenyl)butanoic acid Openeye Name: 3-(3-chlorophenyl)-4-cyano-4-(4-fluorophenyl)butanoic acid CAS Name: 3-(3-chlorophenyl)-4-cyano-4-(4-fluorophenyl)butanoic acid IUPAC Name: 3-(3-chlorophenyl)-4-cyano-4-(4-fluorophenyl)butanoic acid Traditional Name: 3-(3-chlorophenyl)-4-cyano-4-(4-fluorophenyl)butyric acid Formula: C17H13ClFNO2 MolecularWeight: 317.742023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClFNO2/c18-13-3-1-2-12(8-13)15(9-17(21)22)16(10-20)11-4-6-14(19)7-5-11/h1-8,15-16H,9H2,(H,21,22)