3-butyl-5-(5-oxidanylidene-1,2-dihydro-1,2,4-triazol-3-yl)-1H-pyridin-1-ium-4-one

Systemtic Name: 3-butyl-5-(5-oxidanylidene-1,2-dihydro-1,2,4-triazol-3-yl)-1H-pyridin-1-ium-4-one Openeye Name: 3-butyl-5-(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)-1H-pyridin-1-ium-4-one CAS Name: 3-butyl-5-(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)-1H-pyridin-1-ium-4-one IUPAC Name: 3-butyl-5-(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)-1H-pyridin-1-ium-4-one Traditional Name: 3-butyl-5-(5-keto-1,2-dihydro-1,2,4-triazol-3-yl)-1H-pyridin-1-ium-4-one Formula: C11H15N4O2+ MolecularWeight: 235.2624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C[NH2+]C=C(C1=O)C2=NC(=O)NN2

Isomeric SMILES

CCCCC1=C[NH2+]C=C(C1=O)C2=NC(=O)NN2

InChI

InChI=1S/C11H14N4O2/c1-2-3-4-7-5-12-6-8(9(7)16)10-13-11(17)15-14-10/h5-6H,2-4H2,1H3,(H,12,16)(H2,13,14,15,17)/p+1