4-(4-chlorophenyl)-5-(1,2,4-triazol-4-yl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(4-chlorophenyl)-5-(1,2,4-triazol-4-yl)-1,2-dihydropyrazol-3-one Openeye Name: 4-(4-chlorophenyl)-5-(1,2,4-triazol-4-yl)-1,2-dihydropyrazol-3-one CAS Name: 4-(4-chlorophenyl)-5-(1,2,4-triazol-4-yl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-(4-chlorophenyl)-5-(1,2,4-triazol-4-yl)-1,2-dihydropyrazol-3-one Traditional Name: 4-(4-chlorophenyl)-5-(1,2,4-triazol-4-yl)-3-pyrazolin-3-one Formula: C11H8ClN5O MolecularWeight: 261.66712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(NNC2=O)N3C=NN=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(NNC2=O)N3C=NN=C3)Cl

InChI

InChI=1S/C11H8ClN5O/c12-8-3-1-7(2-4-8)9-10(15-16-11(9)18)17-5-13-14-6-17/h1-6H,(H2,15,16,18)