2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl pyridine-4-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl pyridine-4-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl pyridine-4-carboxylate Traditional Name: isonicotinic acid 2-phthalimidoethyl ester Formula: C16H12N2O4 MolecularWeight: 296.27748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC=NC=C3

InChI

InChI=1S/C16H12N2O4/c19-14-12-3-1-2-4-13(12)15(20)18(14)9-10-22-16(21)11-5-7-17-8-6-11/h1-8H,9-10H2