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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(pyridin-1-ium-3-ylmethyl)propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-(pyridin-1-ium-3-ylmethyl)propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-(3-pyridin-1-iumylmethyl)propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-(pyridin-1-ium-3-ylmethyl)propanamide Traditional Name: 3-phthalimido-N-(pyridin-1-ium-3-ylmethyl)propionamide Formula: C17H16N3O3+ MolecularWeight: 310.32724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O3/c21-15(19-11-12-4-3-8-18-10-12)7-9-20-16(22)13-5-1-2-6-14(13)17(20)23/h1-6,8,10H,7,9,11H2,(H,19,21)/p+1