[3-oxidanylidene-3-[[5-(pyridin-4-ylmethylamino)pyridin-2-yl]amino]propyl]azanium

Systemtic Name: [3-oxidanylidene-3-[[5-(pyridin-4-ylmethylamino)pyridin-2-yl]amino]propyl]azanium Openeye Name: [3-oxo-3-[[5-(4-pyridylmethylamino)-2-pyridyl]amino]propyl]ammonium CAS Name: [3-oxo-3-[[5-(pyridin-4-ylmethylamino)-2-pyridinyl]amino]propyl]ammonium IUPAC Name: [3-oxo-3-[[5-(pyridin-4-ylmethylamino)pyridin-2-yl]amino]propyl]azanium Traditional Name: [3-keto-3-[[5-(4-pyridylmethylamino)-2-pyridyl]amino]propyl]ammonium Formula: C14H18N5O+ MolecularWeight: 272.32562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1NCC2=CC=NC=C2)NC(=O)CC[NH3+]

Isomeric SMILES

C1=CC(=NC=C1NCC2=CC=NC=C2)NC(=O)CC[NH3+]

InChI

InChI=1S/C14H17N5O/c15-6-3-14(20)19-13-2-1-12(10-18-13)17-9-11-4-7-16-8-5-11/h1-2,4-5,7-8,10,17H,3,6,9,15H2,(H,18,19,20)/p+1