2-ethyl-5-(phenylmethyl)-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one

Systemtic Name: 2-ethyl-5-(phenylmethyl)-4-pyridin-3-ylcarbonyl-1H-pyrazol-3-one Openeye Name: 5-benzyl-2-ethyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one CAS Name: 2-ethyl-4-[oxo(3-pyridinyl)methyl]-5-(phenylmethyl)-1H-pyrazol-3-one IUPAC Name: 5-benzyl-2-ethyl-4-(pyridine-3-carbonyl)-1H-pyrazol-3-one Traditional Name: 5-benzyl-2-ethyl-4-nicotinoyl-3-pyrazolin-3-one Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(N1)CC2=CC=CC=C2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CCN1C(=O)C(=C(N1)CC2=CC=CC=C2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H17N3O2/c1-2-21-18(23)16(17(22)14-9-6-10-19-12-14)15(20-21)11-13-7-4-3-5-8-13/h3-10,12,20H,2,11H2,1H3