2-(3-azanylpropyl)-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-one

Systemtic Name: 2-(3-azanylpropyl)-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-one Openeye Name: 2-(3-aminopropyl)-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-one CAS Name: 2-(3-aminopropyl)-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-one IUPAC Name: 2-(3-aminopropyl)-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-one Traditional Name: 2-(3-aminopropyl)-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-one Formula: C9H13N4O+ MolecularWeight: 193.22572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)NN(C2=O)CCCN

Isomeric SMILES

C1=CC=[N+]2C(=C1)NN(C2=O)CCCN

InChI

InChI=1S/C9H12N4O/c10-5-3-7-13-9(14)12-6-2-1-4-8(12)11-13/h1-2,4,6H,3,5,7,10H2/p+1