2-phenyl-5-(pyridin-4-ylmethyl)-4H-pyrazol-3-one

Systemtic Name: 2-phenyl-5-(pyridin-4-ylmethyl)-4H-pyrazol-3-one Openeye Name: 2-phenyl-5-(4-pyridylmethyl)-4H-pyrazol-3-one CAS Name: 2-phenyl-5-(pyridin-4-ylmethyl)-4H-pyrazol-3-one IUPAC Name: 2-phenyl-5-(pyridin-4-ylmethyl)-4H-pyrazol-3-one Traditional Name: 2-phenyl-5-(4-pyridylmethyl)-2-pyrazolin-3-one Formula: C15H13N3O MolecularWeight: 251.28322

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC=C2)CC3=CC=NC=C3

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC=C2)CC3=CC=NC=C3

InChI

InChI=1S/C15H13N3O/c19-15-11-13(10-12-6-8-16-9-7-12)17-18(15)14-4-2-1-3-5-14/h1-9H,10-11H2