butyl 3-[5-(hydroxymethyl)furan-2-yl]benzoate

Systemtic Name: butyl 3-[5-(hydroxymethyl)furan-2-yl]benzoate Openeye Name: butyl 3-[5-(hydroxymethyl)-2-furyl]benzoate CAS Name: 3-[5-(hydroxymethyl)-2-furanyl]benzoic acid butyl ester IUPAC Name: butyl 3-[5-(hydroxymethyl)furan-2-yl]benzoate Traditional Name: 3-(5-methylol-2-furyl)benzoic acid butyl ester Formula: C16H18O4 MolecularWeight: 274.31172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)CO

Isomeric SMILES

CCCCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)CO

InChI

InChI=1S/C16H18O4/c1-2-3-9-19-16(18)13-6-4-5-12(10-13)15-8-7-14(11-17)20-15/h4-8,10,17H,2-3,9,11H2,1H3