4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-a]quinoxaline

Systemtic Name: 4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-a]quinoxaline Openeye Name: 4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-a]quinoxaline CAS Name: 4-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-[1,2,4]triazolo[4,3-a]quinoxaline IUPAC Name: 4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-a]quinoxaline Traditional Name: 4-(4-pyridin-1-ium-2-ylpiperazino)-[1,2,4]triazolo[4,3-a]quinoxaline Formula: C18H18N7+ MolecularWeight: 332.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC4=CC=CC=C4N5C3=NN=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC4=CC=CC=C4N5C3=NN=C5

InChI

InChI=1S/C18H17N7/c1-2-6-15-14(5-1)21-17(18-22-20-13-25(15)18)24-11-9-23(10-12-24)16-7-3-4-8-19-16/h1-8,13H,9-12H2/p+1