2-(4-chlorophenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-one

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(=CN2)N3C=NC=N3)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C(=CN2)N3C=NC=N3)Cl

InChI

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