(E)-3-(2-ethynylphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-ethynylphenyl)prop-2-enoic acid Openeye Name: (E)-3-(2-ethynylphenyl)prop-2-enoic acid CAS Name: (E)-3-(2-ethynylphenyl)-2-propenoic acid IUPAC Name: (E)-3-(2-ethynylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(2-ethynylphenyl)acrylic acid Formula: C11H8O2 MolecularWeight: 172.18002

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=CC=C1C=CC(=O)O

Isomeric SMILES

C#CC1=CC=CC=C1/C=C/C(=O)O

InChI

InChI=1S/C11H8O2/c1-2-9-5-3-4-6-10(9)7-8-11(12)13/h1,3-8H,(H,12,13)/b8-7+