N-[2-(1H-benzimidazol-3-ium-2-yl)ethyl]-2-methyl-propanamide

Systemtic Name: N-[2-(1H-benzimidazol-3-ium-2-yl)ethyl]-2-methyl-propanamide Openeye Name: N-[2-(1H-benzimidazol-3-ium-2-yl)ethyl]-2-methyl-propanamide CAS Name: N-[2-(1H-benzimidazol-3-ium-2-yl)ethyl]-2-methylpropanamide IUPAC Name: N-[2-(1H-benzimidazol-3-ium-2-yl)ethyl]-2-methylpropanamide Traditional Name: N-[2-(1H-benzimidazol-3-ium-2-yl)ethyl]-2-methyl-propionamide Formula: C13H18N3O+ MolecularWeight: 232.30152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCC1=[NH+]C2=CC=CC=C2N1

Isomeric SMILES

CC(C)C(=O)NCCC1=[NH+]C2=CC=CC=C2N1

InChI

InChI=1S/C13H17N3O/c1-9(2)13(17)14-8-7-12-15-10-5-3-4-6-11(10)16-12/h3-6,9H,7-8H2,1-2H3,(H,14,17)(H,15,16)/p+1