(E)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]pent-2-enedioic acid

Systemtic Name: (E)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]pent-2-enedioic acid Openeye Name: (E)-2-(1,3-dioxoisoindolin-2-yl)pent-2-enedioic acid CAS Name: (E)-2-(1,3-dioxo-2-isoindolyl)-2-pentenedioic acid IUPAC Name: (E)-2-(1,3-dioxoisoindol-2-yl)pent-2-enedioic acid Traditional Name: (E)-2-phthalimidopent-2-enedioic acid Formula: C13H9NO6 MolecularWeight: 275.21366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C(=CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)/C(=C/CC(=O)O)/C(=O)O

InChI

InChI=1S/C13H9NO6/c15-10(16)6-5-9(13(19)20)14-11(17)7-3-1-2-4-8(7)12(14)18/h1-5H,6H2,(H,15,16)(H,19,20)/b9-5+