2-(1,4-diazepan-4-ium-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium

Systemtic Name: 2-(1,4-diazepan-4-ium-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium Openeye Name: 2-(1,4-diazepan-4-ium-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium CAS Name: 2-(1,4-diazepan-4-ium-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium IUPAC Name: 2-(1,4-diazepan-4-ium-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium Traditional Name: 2-(1,4-diazepan-4-ium-1-ylmethyl)-1H-imidazo[1,2-a]pyridin-4-ium Formula: C13H20N4+2 MolecularWeight: 232.3247

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)CC2=C[N+]3=CC=CC=C3N2

Isomeric SMILES

C1C[NH2+]CCN(C1)CC2=C[N+]3=CC=CC=C3N2

InChI

InChI=1S/C13H18N4/c1-2-8-17-11-12(15-13(17)4-1)10-16-7-3-5-14-6-9-16/h1-2,4,8,11,14H,3,5-7,9-10H2/p+2