2-ethynyl-4-methyl-benzoic acid

Systemtic Name: 2-ethynyl-4-methyl-benzoic acid Openeye Name: 2-ethynyl-4-methyl-benzoic acid CAS Name: 2-ethynyl-4-methylbenzoic acid IUPAC Name: 2-ethynyl-4-methylbenzoic acid Traditional Name: 2-ethynyl-4-methyl-benzoic acid Formula: C10H8O2 MolecularWeight: 160.16932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8O2/c1-3-8-6-7(2)4-5-9(8)10(11)12/h1,4-6H,2H3,(H,11,12)