4-cyclohexa-1,5-dien-1-yl-4-methyl-1H-1,2,3,4-tetrazol-4-ium-5-one

Systemtic Name: 4-cyclohexa-1,5-dien-1-yl-4-methyl-1H-1,2,3,4-tetrazol-4-ium-5-one Openeye Name: 4-cyclohexa-1,5-dien-1-yl-4-methyl-1H-tetrazol-4-ium-5-one CAS Name: 4-(1-cyclohexa-1,5-dienyl)-4-methyl-1H-tetrazol-4-ium-5-one IUPAC Name: 4-cyclohexa-1,5-dien-1-yl-4-methyl-1H-tetrazol-4-ium-5-one Traditional Name: 4-cyclohexa-1,5-dien-1-yl-4-methyl-1H-tetrazol-4-ium-5-one Formula: C8H11N4O+ MolecularWeight: 179.19914

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)NN=N1)C2=CCCC=C2

Isomeric SMILES

C[N+]1(C(=O)NN=N1)C2=CCCC=C2

InChI

InChI=1S/C8H10N4O/c1-12(8(13)9-10-11-12)7-5-3-2-4-6-7/h3,5-6H,2,4H2,1H3/p+1