2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-pyridin-1-ium-3-yl-propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-pyridin-1-ium-3-yl-propanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-pyridin-1-ium-3-yl-propanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(3-pyridin-1-iumyl)propanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-pyridin-1-ium-3-ylpropanamide Traditional Name: 2-phthalimido-N-pyridin-1-ium-3-yl-propionamide Formula: C16H14N3O3+ MolecularWeight: 296.30066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C[NH+]=CC=C1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C(=O)NC1=C[NH+]=CC=C1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H13N3O3/c1-10(14(20)18-11-5-4-8-17-9-11)19-15(21)12-6-2-3-7-13(12)16(19)22/h2-10H,1H3,(H,18,20)/p+1