actinium; 4-[[4-(hydroxymethyl)-1H-imidazol-3-ium-3-yl]methyl]benzenecarbonitrile

Systemtic Name: actinium; 4-[[4-(hydroxymethyl)-1H-imidazol-3-ium-3-yl]methyl]benzenecarbonitrile Openeye Name: actinium; 4-[[4-(hydroxymethyl)-1H-imidazol-3-ium-3-yl]methyl]benzonitrile CAS Name: actinium; 4-[[4-(hydroxymethyl)-1H-imidazol-3-ium-3-yl]methyl]benzonitrile IUPAC Name: actinium; 4-[[4-(hydroxymethyl)-1H-imidazol-3-ium-3-yl]methyl]benzonitrile Traditional Name: actinium; 4-[(4-methylol-1H-imidazol-3-ium-3-yl)methyl]benzonitrile Formula: C12H12AcN3O+ MolecularWeight: 441.270927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[N+]2=CNC=C2CO)C#N.[Ac]

Isomeric SMILES

C1=CC(=CC=C1C[N+]2=CNC=C2CO)C#N.[Ac]

InChI

InChI=1S/C12H11N3O.Ac/c13-5-10-1-3-11(4-2-10)7-15-9-14-6-12(15)8-16;/h1-4,6,9,16H,7-8H2;/p+1