3-ethyl-5-[2-(2-phenylethynyl)phenyl]penta-3,4-dien-2-one

Systemtic Name: 3-ethyl-5-[2-(2-phenylethynyl)phenyl]penta-3,4-dien-2-one Openeye Name: 3-ethyl-5-[2-(2-phenylethynyl)phenyl]penta-3,4-dien-2-one CAS Name: 3-ethyl-5-[2-(2-phenylethynyl)phenyl]-2-penta-3,4-dienone IUPAC Name: 3-ethyl-5-[2-(2-phenylethynyl)phenyl]penta-3,4-dien-2-one Traditional Name: 3-ethyl-5-[2-(2-phenylethynyl)phenyl]penta-3,4-dien-2-one Formula: C21H18O MolecularWeight: 286.36702

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C=CC1=CC=CC=C1C#CC2=CC=CC=C2)C(=O)C

Isomeric SMILES

CCC(=C=CC1=CC=CC=C1C#CC2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C21H18O/c1-3-19(17(2)22)15-16-21-12-8-7-11-20(21)14-13-18-9-5-4-6-10-18/h4-12,16H,3H2,1-2H3