[2-oxidanylidene-2-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-2-yl]amino]ethyl]azanium

Systemtic Name: [2-oxidanylidene-2-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-2-yl]amino]ethyl]azanium Openeye Name: [2-oxo-2-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-pyridyl]amino]ethyl]ammonium CAS Name: [2-oxo-2-[[5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-pyridinyl]amino]ethyl]ammonium IUPAC Name: [2-oxo-2-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-2-yl]amino]ethyl]azanium Traditional Name: [2-keto-2-[[5-(4-pyridin-1-ium-2-ylpiperazino)-2-pyridyl]amino]ethyl]ammonium Formula: C16H22N6O+2 MolecularWeight: 314.38548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)NC(=O)C[NH3+])C3=CC=CC=[NH+]3

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)NC(=O)C[NH3+])C3=CC=CC=[NH+]3

InChI

InChI=1S/C16H20N6O/c17-11-16(23)20-14-5-4-13(12-19-14)21-7-9-22(10-8-21)15-3-1-2-6-18-15/h1-6,12H,7-11,17H2,(H,19,20,23)/p+2