4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]methyl]-5-methyl-furan-2-carboxylic acid

Systemtic Name: 4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]methyl]-5-methyl-furan-2-carboxylic acid Openeye Name: 4-[[2-(1,3-dioxoisoindolin-2-yl)phenoxy]methyl]-5-methyl-furan-2-carboxylic acid CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)phenoxy]methyl]-5-methyl-2-furancarboxylic acid IUPAC Name: 4-[[2-(1,3-dioxoisoindol-2-yl)phenoxy]methyl]-5-methylfuran-2-carboxylic acid Traditional Name: 5-methyl-4-[(2-phthalimidophenoxy)methyl]-2-furoic acid Formula: C21H15NO6 MolecularWeight: 377.3469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)O)COC2=CC=CC=C2N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=C(O1)C(=O)O)COC2=CC=CC=C2N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H15NO6/c1-12-13(10-18(28-12)21(25)26)11-27-17-9-5-4-8-16(17)22-19(23)14-6-2-3-7-15(14)20(22)24/h2-10H,11H2,1H3,(H,25,26)