2-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]isoquinolin-2-ium

Systemtic Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]isoquinolin-2-ium Openeye Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]isoquinolin-2-ium CAS Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]isoquinolin-2-ium IUPAC Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]isoquinolin-2-ium Traditional Name: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]isoquinolin-2-ium Formula: C19H18N3+ MolecularWeight: 288.36632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C[N+]3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C[N+]3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C19H18N3/c1-13-9-17-18(10-14(13)2)21-19(20-17)12-22-8-7-15-5-3-4-6-16(15)11-22/h3-11H,12H2,1-2H3,(H,20,21)/q+1