5-(3-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)pentanoate

Systemtic Name: 5-(3-oxidanylidene-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)pentanoate Openeye Name: 5-(3-oxo-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)pentanoate CAS Name: 5-(3-oxo-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)pentanoate IUPAC Name: 5-(3-oxo-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)pentanoate Traditional Name: 5-(3-keto-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-2-yl)valerate Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O3/c15-10(16)6-2-4-8-14-11(17)13-7-3-1-5-9(13)12-14/h1,3,5,7H,2,4,6,8H2,(H,15,16)