5-(4-ethylpiperazin-4-ium-1-yl)-2H-1,2,4-triazin-3-one

Systemtic Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2H-1,2,4-triazin-3-one Openeye Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2H-1,2,4-triazin-3-one CAS Name: 5-(4-ethyl-1-piperazin-4-iumyl)-2H-1,2,4-triazin-3-one IUPAC Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2H-1,2,4-triazin-3-one Traditional Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2H-1,2,4-triazin-3-one Formula: C9H16N5O+ MolecularWeight: 210.25624

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=O)NN=C2

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=O)NN=C2

InChI

InChI=1S/C9H15N5O/c1-2-13-3-5-14(6-4-13)8-7-10-12-9(15)11-8/h7H,2-6H2,1H3,(H,11,12,15)/p+1