2-[2-[4-(3-cyano-4-fluoranyl-phenyl)phenyl]ethyl]-5-phenyl-pentanoic acid

Systemtic Name: 2-[2-[4-(3-cyano-4-fluoranyl-phenyl)phenyl]ethyl]-5-phenyl-pentanoic acid Openeye Name: 2-[2-[4-(3-cyano-4-fluoro-phenyl)phenyl]ethyl]-5-phenyl-pentanoic acid CAS Name: 2-[2-[4-(3-cyano-4-fluorophenyl)phenyl]ethyl]-5-phenylpentanoic acid IUPAC Name: 2-[2-[4-(3-cyano-4-fluorophenyl)phenyl]ethyl]-5-phenylpentanoic acid Traditional Name: 2-[2-[4-(3-cyano-4-fluoro-phenyl)phenyl]ethyl]-5-phenyl-valeric acid Formula: C26H24FNO2 MolecularWeight: 401.472663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(CCC2=CC=C(C=C2)C3=CC(=C(C=C3)F)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC(CCC2=CC=C(C=C2)C3=CC(=C(C=C3)F)C#N)C(=O)O

InChI

InChI=1S/C26H24FNO2/c27-25-16-15-23(17-24(25)18-28)21-12-9-20(10-13-21)11-14-22(26(29)30)8-4-7-19-5-2-1-3-6-19/h1-3,5-6,9-10,12-13,15-17,22H,4,7-8,11,14H2,(H,29,30)