5-methyl-2-propyl-furan-3-carboxylic acid

Systemtic Name: 5-methyl-2-propyl-furan-3-carboxylic acid Openeye Name: 5-methyl-2-propyl-furan-3-carboxylic acid CAS Name: 5-methyl-2-propyl-3-furancarboxylic acid IUPAC Name: 5-methyl-2-propylfuran-3-carboxylic acid Traditional Name: 5-methyl-2-propyl-3-furoic acid Formula: C9H12O3 MolecularWeight: 168.18978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(O1)C)C(=O)O

Isomeric SMILES

CCCC1=C(C=C(O1)C)C(=O)O

InChI

InChI=1S/C9H12O3/c1-3-4-8-7(9(10)11)5-6(2)12-8/h5H,3-4H2,1-2H3,(H,10,11)