3-(diethylamino)-6-(4H-1,2,4-triazol-4-ium-3-ylhydrazinylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 3-(diethylamino)-6-(4H-1,2,4-triazol-4-ium-3-ylhydrazinylidene)cyclohexa-2,4-dien-1-one Openeye Name: 3-(diethylamino)-6-(4H-1,2,4-triazol-4-ium-3-ylhydrazono)cyclohexa-2,4-dien-1-one CAS Name: 3-(diethylamino)-6-(4H-1,2,4-triazol-4-ium-3-ylhydrazinylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 3-(diethylamino)-6-(4H-1,2,4-triazol-4-ium-3-ylhydrazinylidene)cyclohexa-2,4-dien-1-one Traditional Name: 3-(diethylamino)-6-(4H-1,2,4-triazol-4-ium-3-ylhydrazono)cyclohexa-2,4-dien-1-one Formula: C12H17N6O+ MolecularWeight: 261.30298

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=O)C(=NNC2=NN=C[NH2+]2)C=C1

Isomeric SMILES

CCN(CC)C1=CC(=O)C(=NNC2=NN=C[NH2+]2)C=C1

InChI

InChI=1S/C12H16N6O/c1-3-18(4-2)9-5-6-10(11(19)7-9)15-17-12-13-8-14-16-12/h5-8H,3-4H2,1-2H3,(H2,13,14,16,17)/p+1