3-(4-fluoranyl-3-methyl-phenyl)prop-2-ynoic acid

Systemtic Name: 3-(4-fluoranyl-3-methyl-phenyl)prop-2-ynoic acid Openeye Name: 3-(4-fluoro-3-methyl-phenyl)prop-2-ynoic acid CAS Name: 3-(4-fluoro-3-methylphenyl)-2-propynoic acid IUPAC Name: 3-(4-fluoro-3-methylphenyl)prop-2-ynoic acid Traditional Name: 3-(4-fluoro-3-methyl-phenyl)propiolic acid Formula: C10H7FO2 MolecularWeight: 178.159783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7FO2/c1-7-6-8(2-4-9(7)11)3-5-10(12)13/h2,4,6H,1H3,(H,12,13)