5-(hexoxymethyl)-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-(hexoxymethyl)-2-methyl-furan-3-carboxylic acid Openeye Name: 5-(hexoxymethyl)-2-methyl-furan-3-carboxylic acid CAS Name: 5-(hexoxymethyl)-2-methyl-3-furancarboxylic acid IUPAC Name: 5-(hexoxymethyl)-2-methylfuran-3-carboxylic acid Traditional Name: 5-(hexoxymethyl)-2-methyl-3-furoic acid Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC1=CC(=C(O1)C)C(=O)O

Isomeric SMILES

CCCCCCOCC1=CC(=C(O1)C)C(=O)O

InChI

InChI=1S/C13H20O4/c1-3-4-5-6-7-16-9-11-8-12(13(14)15)10(2)17-11/h8H,3-7,9H2,1-2H3,(H,14,15)