methyl 4-hex-1-ynyl-5-methanoyl-furan-2-carboxylate

Systemtic Name: methyl 4-hex-1-ynyl-5-methanoyl-furan-2-carboxylate Openeye Name: methyl 5-formyl-4-hex-1-ynyl-furan-2-carboxylate CAS Name: 5-formyl-4-hex-1-ynyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-formyl-4-hex-1-ynylfuran-2-carboxylate Traditional Name: 5-formyl-4-hex-1-ynyl-furan-2-carboxylic acid methyl ester Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(OC(=C1)C(=O)OC)C=O

Isomeric SMILES

CCCCC#CC1=C(OC(=C1)C(=O)OC)C=O

InChI

InChI=1S/C13H14O4/c1-3-4-5-6-7-10-8-11(13(15)16-2)17-12(10)9-14/h8-9H,3-5H2,1-2H3