2-[4-methoxy-2-methyl-1,3-bis(oxidanylidene)isoindol-2-ium-2-yl]-3-methyl-butanenitrile

Systemtic Name: 2-[4-methoxy-2-methyl-1,3-bis(oxidanylidene)isoindol-2-ium-2-yl]-3-methyl-butanenitrile Openeye Name: 2-(4-methoxy-2-methyl-1,3-dioxo-isoindolin-2-ium-2-yl)-3-methyl-butanenitrile CAS Name: 2-(4-methoxy-2-methyl-1,3-dioxo-2-isoindol-2-iumyl)-3-methylbutanenitrile IUPAC Name: 2-(4-methoxy-2-methyl-1,3-dioxoisoindol-2-ium-2-yl)-3-methylbutanenitrile Traditional Name: 2-(1,3-diketo-4-methoxy-2-methyl-isoindolin-2-ium-2-yl)-3-methyl-butyronitrile Formula: C15H17N2O3+ MolecularWeight: 273.30708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)[N+]1(C(=O)C2=C(C1=O)C(=CC=C2)OC)C

Isomeric SMILES

CC(C)C(C#N)[N+]1(C(=O)C2=C(C1=O)C(=CC=C2)OC)C

InChI

InChI=1S/C15H17N2O3/c1-9(2)11(8-16)17(3)14(18)10-6-5-7-12(20-4)13(10)15(17)19/h5-7,9,11H,1-4H3/q+1