3-azanylidene-2-(hydroxymethyl)-2-methyl-isoindol-2-ium-1-one

Systemtic Name: 3-azanylidene-2-(hydroxymethyl)-2-methyl-isoindol-2-ium-1-one Openeye Name: 2-(hydroxymethyl)-3-imino-2-methyl-isoindolin-2-ium-1-one CAS Name: 2-(hydroxymethyl)-3-imino-2-methyl-1-isoindol-2-iumone IUPAC Name: 2-(hydroxymethyl)-3-imino-2-methylisoindol-2-ium-1-one Traditional Name: 3-imino-2-methyl-2-methylol-isoindolin-2-ium-1-one Formula: C10H11N2O2+ MolecularWeight: 191.20654

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=N)C2=CC=CC=C2C1=O)CO

Isomeric SMILES

C[N+]1(C(=N)C2=CC=CC=C2C1=O)CO

InChI

InChI=1S/C10H11N2O2/c1-12(6-13)9(11)7-4-2-3-5-8(7)10(12)14/h2-5,11,13H,6H2,1H3/q+1