2-(4-butylphenyl)-4-methyl-5-pyridin-3-yl-4H-pyrazol-3-one

Systemtic Name: 2-(4-butylphenyl)-4-methyl-5-pyridin-3-yl-4H-pyrazol-3-one Openeye Name: 2-(4-butylphenyl)-4-methyl-5-(3-pyridyl)-4H-pyrazol-3-one CAS Name: 2-(4-butylphenyl)-4-methyl-5-(3-pyridinyl)-4H-pyrazol-3-one IUPAC Name: 2-(4-butylphenyl)-4-methyl-5-pyridin-3-yl-4H-pyrazol-3-one Traditional Name: 2-(4-butylphenyl)-4-methyl-5-(3-pyridyl)-2-pyrazolin-3-one Formula: C19H21N3O MolecularWeight: 307.38954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(C(=N2)C3=CN=CC=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(C(=N2)C3=CN=CC=C3)C

InChI

InChI=1S/C19H21N3O/c1-3-4-6-15-8-10-17(11-9-15)22-19(23)14(2)18(21-22)16-7-5-12-20-13-16/h5,7-14H,3-4,6H2,1-2H3