5-hex-1-ynylfuran-2-carboxylic acid

Systemtic Name: 5-hex-1-ynylfuran-2-carboxylic acid Openeye Name: 5-hex-1-ynylfuran-2-carboxylic acid CAS Name: 5-hex-1-ynyl-2-furancarboxylic acid IUPAC Name: 5-hex-1-ynylfuran-2-carboxylic acid Traditional Name: 5-hex-1-ynyl-2-furoic acid Formula: C11H12O3 MolecularWeight: 192.21118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC=C(O1)C(=O)O

Isomeric SMILES

CCCCC#CC1=CC=C(O1)C(=O)O

InChI

InChI=1S/C11H12O3/c1-2-3-4-5-6-9-7-8-10(14-9)11(12)13/h7-8H,2-4H2,1H3,(H,12,13)