2-[1-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-6-methyl-1H-benzimidazole

Systemtic Name: 2-[1-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-6-methyl-1H-benzimidazole Openeye Name: 2-[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-6-methyl-1H-benzimidazole CAS Name: 2-[1-[(1-cyclopropyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]-6-methyl-1H-benzimidazole IUPAC Name: 2-[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-6-methyl-1H-benzimidazole Traditional Name: 2-[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-6-methyl-1H-benzimidazole Formula: C18H24N7+ MolecularWeight: 338.43006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C3CC[NH+](CC3)CC4=NN=NN4C5CC5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C3CC[NH+](CC3)CC4=NN=NN4C5CC5

InChI

InChI=1S/C18H23N7/c1-12-2-5-15-16(10-12)20-18(19-15)13-6-8-24(9-7-13)11-17-21-22-23-25(17)14-3-4-14/h2,5,10,13-14H,3-4,6-9,11H2,1H3,(H,19,20)/p+1