(E)-4-[4-[(4-methylphenyl)methyl]furan-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[4-[(4-methylphenyl)methyl]furan-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-hydroxy-2-oxo-4-[4-(p-tolylmethyl)-3-furyl]but-3-enoic acid CAS Name: (E)-4-hydroxy-4-[4-[(4-methylphenyl)methyl]-3-furanyl]-2-oxo-3-butenoic acid IUPAC Name: (E)-4-hydroxy-4-[4-[(4-methylphenyl)methyl]furan-3-yl]-2-oxobut-3-enoic acid Traditional Name: (E)-4-hydroxy-2-keto-4-[4-(4-methylbenzyl)-3-furyl]but-3-enoic acid Formula: C16H14O5 MolecularWeight: 286.27936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=COC=C2C(=CC(=O)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=COC=C2/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C16H14O5/c1-10-2-4-11(5-3-10)6-12-8-21-9-13(12)14(17)7-15(18)16(19)20/h2-5,7-9,17H,6H2,1H3,(H,19,20)/b14-7+