methyl 4-(hydroxymethyl)-2-(2-methylpropyl)furan-3-carboxylate

Systemtic Name: methyl 4-(hydroxymethyl)-2-(2-methylpropyl)furan-3-carboxylate Openeye Name: methyl 4-(hydroxymethyl)-2-isobutyl-furan-3-carboxylate CAS Name: 4-(hydroxymethyl)-2-(2-methylpropyl)-3-furancarboxylic acid methyl ester IUPAC Name: methyl 4-(hydroxymethyl)-2-(2-methylpropyl)furan-3-carboxylate Traditional Name: 2-isobutyl-4-methylol-furan-3-carboxylic acid methyl ester Formula: C11H16O4 MolecularWeight: 212.24234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=CO1)CO)C(=O)OC

Isomeric SMILES

CC(C)CC1=C(C(=CO1)CO)C(=O)OC

InChI

InChI=1S/C11H16O4/c1-7(2)4-9-10(11(13)14-3)8(5-12)6-15-9/h6-7,12H,4-5H2,1-3H3