4-butyl-2-phenyl-5-pyridin-3-yl-4H-pyrazol-3-one

Systemtic Name: 4-butyl-2-phenyl-5-pyridin-3-yl-4H-pyrazol-3-one Openeye Name: 4-butyl-2-phenyl-5-(3-pyridyl)-4H-pyrazol-3-one CAS Name: 4-butyl-2-phenyl-5-(3-pyridinyl)-4H-pyrazol-3-one IUPAC Name: 4-butyl-2-phenyl-5-pyridin-3-yl-4H-pyrazol-3-one Traditional Name: 4-butyl-2-phenyl-5-(3-pyridyl)-2-pyrazolin-3-one Formula: C18H19N3O MolecularWeight: 293.36296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=NN(C1=O)C2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

CCCCC1C(=NN(C1=O)C2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C18H19N3O/c1-2-3-11-16-17(14-8-7-12-19-13-14)20-21(18(16)22)15-9-5-4-6-10-15/h4-10,12-13,16H,2-3,11H2,1H3