5-ethanoyl-2-[(3-methylphenyl)methyl]furan-3-carboxylic acid

Systemtic Name: 5-ethanoyl-2-[(3-methylphenyl)methyl]furan-3-carboxylic acid Openeye Name: 5-acetyl-2-(m-tolylmethyl)furan-3-carboxylic acid CAS Name: 5-acetyl-2-[(3-methylphenyl)methyl]-3-furancarboxylic acid IUPAC Name: 5-acetyl-2-[(3-methylphenyl)methyl]furan-3-carboxylic acid Traditional Name: 5-acetyl-2-(3-methylbenzyl)-3-furoic acid Formula: C15H14O4 MolecularWeight: 258.26926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(C=C(O2)C(=O)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(C=C(O2)C(=O)C)C(=O)O

InChI

InChI=1S/C15H14O4/c1-9-4-3-5-11(6-9)7-14-12(15(17)18)8-13(19-14)10(2)16/h3-6,8H,7H2,1-2H3,(H,17,18)