(E)-3-[4-(2-phenylethynyl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-phenylethynyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-phenylethynyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-phenylethynyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-phenylethynyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-phenylethynyl)phenyl]acrylic acid Formula: C17H12O2 MolecularWeight: 248.27598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C17H12O2/c18-17(19)13-12-16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-5,8-13H,(H,18,19)/b13-12+