(E)-4-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-cyano-but-3-enoate

Systemtic Name: (E)-4-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-cyano-but-3-enoate Openeye Name: (E)-4-cyano-4-(1,3-dioxoisoindolin-2-yl)but-3-enoate CAS Name: (E)-4-cyano-4-(1,3-dioxo-2-isoindolyl)-3-butenoate IUPAC Name: (E)-4-cyano-4-(1,3-dioxoisoindol-2-yl)but-3-enoate Traditional Name: (E)-4-cyano-4-phthalimido-but-3-enoate Formula: C13H7N2O4- MolecularWeight: 255.20568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C(=CCC(=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)/C(=C/CC(=O)[O-])/C#N

InChI

InChI=1S/C13H8N2O4/c14-7-8(5-6-11(16)17)15-12(18)9-3-1-2-4-10(9)13(15)19/h1-5H,6H2,(H,16,17)/p-1/b8-5+