2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(pyridin-1-ium-4-ylmethyl)ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(pyridin-1-ium-4-ylmethyl)ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(pyridin-1-ium-4-ylmethyl)acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(4-pyridin-1-iumylmethyl)acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(pyridin-1-ium-4-ylmethyl)acetamide Traditional Name: 2-phthalimido-N-(pyridin-1-ium-4-ylmethyl)acetamide Formula: C16H14N3O3+ MolecularWeight: 296.30066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)NCC3=CC=[NH+]C=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)NCC3=CC=[NH+]C=C3

InChI

InChI=1S/C16H13N3O3/c20-14(18-9-11-5-7-17-8-6-11)10-19-15(21)12-3-1-2-4-13(12)16(19)22/h1-8H,9-10H2,(H,18,20)/p+1