methyl 3,3,5-trimethyl-2-(2-methylpropyl)-2H-furan-4-carboxylate

Systemtic Name: methyl 3,3,5-trimethyl-2-(2-methylpropyl)-2H-furan-4-carboxylate Openeye Name: methyl 2-isobutyl-3,3,5-trimethyl-2H-furan-4-carboxylate CAS Name: 3,3,5-trimethyl-2-(2-methylpropyl)-2H-furan-4-carboxylic acid methyl ester IUPAC Name: methyl 3,3,5-trimethyl-2-(2-methylpropyl)-2H-furan-4-carboxylate Traditional Name: 2-isobutyl-3,3,5-trimethyl-2H-furan-4-carboxylic acid methyl ester Formula: C13H22O3 MolecularWeight: 226.31198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(O1)CC(C)C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(C(O1)CC(C)C)(C)C)C(=O)OC

InChI

InChI=1S/C13H22O3/c1-8(2)7-10-13(4,5)11(9(3)16-10)12(14)15-6/h8,10H,7H2,1-6H3