1-[5,6-dimethyl-3-(phenylmethyl)benzimidazol-3-ium-1-yl]propan-2-one

Systemtic Name: 1-[5,6-dimethyl-3-(phenylmethyl)benzimidazol-3-ium-1-yl]propan-2-one Openeye Name: 1-(3-benzyl-5,6-dimethyl-benzimidazol-3-ium-1-yl)propan-2-one CAS Name: 1-[5,6-dimethyl-3-(phenylmethyl)-1-benzimidazol-3-iumyl]-2-propanone IUPAC Name: 1-(3-benzyl-5,6-dimethylbenzimidazol-3-ium-1-yl)propan-2-one Traditional Name: 1-(3-benzyl-5,6-dimethyl-benzimidazol-3-ium-1-yl)acetone Formula: C19H21N2O+ MolecularWeight: 293.38284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=CN2CC(=O)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=CN2CC(=O)C)CC3=CC=CC=C3

InChI

InChI=1S/C19H21N2O/c1-14-9-18-19(10-15(14)2)21(13-20(18)11-16(3)22)12-17-7-5-4-6-8-17/h4-10,13H,11-12H2,1-3H3/q+1