2-[2-oxidanylidene-2-[4-[4-(2-phenylethynyl)phenyl]phenyl]ethyl]-5-phenyl-pentanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[4-[4-(2-phenylethynyl)phenyl]phenyl]ethyl]-5-phenyl-pentanoic acid Openeye Name: 2-[2-oxo-2-[4-[4-(2-phenylethynyl)phenyl]phenyl]ethyl]-5-phenyl-pentanoic acid CAS Name: 2-[2-oxo-2-[4-[4-(2-phenylethynyl)phenyl]phenyl]ethyl]-5-phenylpentanoic acid IUPAC Name: 2-[2-oxo-2-[4-[4-(2-phenylethynyl)phenyl]phenyl]ethyl]-5-phenylpentanoic acid Traditional Name: 2-[2-keto-2-[4-[4-(2-phenylethynyl)phenyl]phenyl]ethyl]-5-phenyl-valeric acid Formula: C33H28O3 MolecularWeight: 472.57362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C#CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC(CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C#CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C33H28O3/c34-32(24-31(33(35)36)13-7-12-25-8-3-1-4-9-25)30-22-20-29(21-23-30)28-18-16-27(17-19-28)15-14-26-10-5-2-6-11-26/h1-6,8-11,16-23,31H,7,12-13,24H2,(H,35,36)