3-[[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]methyl]-2H-indazole

Systemtic Name: 3-[[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]methyl]-2H-indazole Openeye Name: 3-[[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]methyl]-2H-indazole CAS Name: 3-[[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-piperazinyl]methyl]-2H-indazole IUPAC Name: 3-[[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]methyl]-2H-indazole Traditional Name: 3-[[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazino]methyl]-2H-indazole Formula: C17H23N6+ MolecularWeight: 311.40472

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)CN2CCN(CC2)CC3=C4C=CC=CC4=NN3

Isomeric SMILES

C[N+]1=C(NC=C1)CN2CCN(CC2)CC3=C4C=CC=CC4=NN3

InChI

InChI=1S/C17H22N6/c1-21-7-6-18-17(21)13-23-10-8-22(9-11-23)12-16-14-4-2-3-5-15(14)19-20-16/h2-7H,8-13H2,1H3,(H,19,20)/p+1