3-[2-(2-phenylethynyl)phenyl]-1-benzothiophene

Systemtic Name: 3-[2-(2-phenylethynyl)phenyl]-1-benzothiophene Openeye Name: 3-[2-(2-phenylethynyl)phenyl]benzothiophene CAS Name: 3-[2-(2-phenylethynyl)phenyl]-1-benzothiophene IUPAC Name: 3-[2-(2-phenylethynyl)phenyl]-1-benzothiophene Traditional Name: 3-[2-(2-phenylethynyl)phenyl]benzothiophene Formula: C22H14S MolecularWeight: 310.41156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=CC=C2C3=CSC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=CC=C2C3=CSC4=CC=CC=C43

InChI

InChI=1S/C22H14S/c1-2-8-17(9-3-1)14-15-18-10-4-5-11-19(18)21-16-23-22-13-7-6-12-20(21)22/h1-13,16H