2-[2,6-bis(oxidanylidene)piperidin-3-yl]-4-(3-oxidanylprop-1-ynyl)isoindole-1,3-dione

Systemtic Name: 2-[2,6-bis(oxidanylidene)piperidin-3-yl]-4-(3-oxidanylprop-1-ynyl)isoindole-1,3-dione Openeye Name: 2-(2,6-dioxo-3-piperidyl)-4-(3-hydroxyprop-1-ynyl)isoindoline-1,3-dione CAS Name: 2-(2,6-dioxo-3-piperidinyl)-4-(3-hydroxyprop-1-ynyl)isoindole-1,3-dione IUPAC Name: 2-(2,6-dioxopiperidin-3-yl)-4-(3-hydroxyprop-1-ynyl)isoindole-1,3-dione Traditional Name: 2-(2,6-diketo-3-piperidyl)-4-(3-hydroxyprop-1-ynyl)isoindoline-1,3-quinone Formula: C16H12N2O5 MolecularWeight: 312.27688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC(=C3C2=O)C#CCO

Isomeric SMILES

C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC(=C3C2=O)C#CCO

InChI

InChI=1S/C16H12N2O5/c19-8-2-4-9-3-1-5-10-13(9)16(23)18(15(10)22)11-6-7-12(20)17-14(11)21/h1,3,5,11,19H,6-8H2,(H,17,20,21)