[3-oxidanylidene-3-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-2-yl]amino]propyl]azanium

Systemtic Name: [3-oxidanylidene-3-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-2-yl]amino]propyl]azanium Openeye Name: [3-oxo-3-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-pyridyl]amino]propyl]ammonium CAS Name: [3-oxo-3-[[5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-pyridinyl]amino]propyl]ammonium IUPAC Name: [3-oxo-3-[[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-2-yl]amino]propyl]azanium Traditional Name: [3-keto-3-[[5-(4-pyridin-1-ium-2-ylpiperazino)-2-pyridyl]amino]propyl]ammonium Formula: C17H24N6O+2 MolecularWeight: 328.41206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N6O/c18-7-6-17(24)21-15-5-4-14(13-20-15)22-9-11-23(12-10-22)16-3-1-2-8-19-16/h1-5,8,13H,6-7,9-12,18H2,(H,20,21,24)/p+2