3-methyl-4-[(2-phenyl-1,2,3-triazol-4-yl)diazenyl]-1,4-dihydropyrazol-5-one

Systemtic Name: 3-methyl-4-[(2-phenyl-1,2,3-triazol-4-yl)diazenyl]-1,4-dihydropyrazol-5-one Openeye Name: 3-methyl-4-(2-phenyltriazol-4-yl)azo-1,4-dihydropyrazol-5-one CAS Name: 3-methyl-4-[(2-phenyl-4-triazolyl)azo]-1,4-dihydropyrazol-5-one IUPAC Name: 3-methyl-4-[(2-phenyltriazol-4-yl)diazenyl]-1,4-dihydropyrazol-5-one Traditional Name: 5-methyl-4-(2-phenyltriazol-4-yl)azo-2-pyrazolin-3-one Formula: C12H11N7O MolecularWeight: 269.26204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C1N=NC2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NNC(=O)C1N=NC2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C12H11N7O/c1-8-11(12(20)17-14-8)16-15-10-7-13-19(18-10)9-5-3-2-4-6-9/h2-7,11H,1H3,(H,17,20)