[4-chloranyl-2-(2-phenylethynyl)phenyl] ethanoate

Systemtic Name: [4-chloranyl-2-(2-phenylethynyl)phenyl] ethanoate Openeye Name: [4-chloro-2-(2-phenylethynyl)phenyl] acetate CAS Name: acetic acid [4-chloro-2-(2-phenylethynyl)phenyl] ester IUPAC Name: [4-chloro-2-(2-phenylethynyl)phenyl] acetate Traditional Name: acetic acid [4-chloro-2-(2-phenylethynyl)phenyl] ester Formula: C16H11ClO2 MolecularWeight: 270.71034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)Cl)C#CC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)Cl)C#CC2=CC=CC=C2

InChI

InChI=1S/C16H11ClO2/c1-12(18)19-16-10-9-15(17)11-14(16)8-7-13-5-3-2-4-6-13/h2-6,9-11H,1H3