2-[(5-oxidanylidene-1H-pyrazol-2-yl)-phenyl-methyl]-1H-pyrazol-5-one

Systemtic Name: 2-[(5-oxidanylidene-1H-pyrazol-2-yl)-phenyl-methyl]-1H-pyrazol-5-one Openeye Name: 2-[(5-oxo-1H-pyrazol-2-yl)-phenyl-methyl]-1H-pyrazol-5-one CAS Name: 2-[(5-oxo-1H-pyrazol-2-yl)-phenylmethyl]-1H-pyrazol-5-one IUPAC Name: 2-[(5-oxo-1H-pyrazol-2-yl)-phenylmethyl]-1H-pyrazol-5-one Traditional Name: 1-[(3-keto-3-pyrazolin-1-yl)-phenyl-methyl]-3-pyrazolin-3-one Formula: C13H12N4O2 MolecularWeight: 256.25998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(N2C=CC(=O)N2)N3C=CC(=O)N3

Isomeric SMILES

C1=CC=C(C=C1)C(N2C=CC(=O)N2)N3C=CC(=O)N3

InChI

InChI=1S/C13H12N4O2/c18-11-6-8-16(14-11)13(10-4-2-1-3-5-10)17-9-7-12(19)15-17/h1-9,13H,(H,14,18)(H,15,19)