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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-N-pyridin-1-ium-3-yl-butanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-3-methyl-N-pyridin-1-ium-3-yl-butanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-methyl-N-(3-pyridin-1-iumyl)butanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-3-methyl-N-pyridin-1-ium-3-ylbutanamide Traditional Name: 3-methyl-2-phthalimido-N-pyridin-1-ium-3-yl-butyramide Formula: C18H18N3O3+ MolecularWeight: 324.35382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O3/c1-11(2)15(16(22)20-12-6-5-9-19-10-12)21-17(23)13-7-3-4-8-14(13)18(21)24/h3-11,15H,1-2H3,(H,20,22)/p+1