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

Systemtic Name: 2-(4-butoxyphenyl)-4-methyl-5-pyridin-3-yl-4H-pyrazol-3-one Openeye Name: 2-(4-butoxyphenyl)-4-methyl-5-(3-pyridyl)-4H-pyrazol-3-one CAS Name: 2-(4-butoxyphenyl)-4-methyl-5-(3-pyridinyl)-4H-pyrazol-3-one IUPAC Name: 2-(4-butoxyphenyl)-4-methyl-5-pyridin-3-yl-4H-pyrazol-3-one Traditional Name: 2-(4-butoxyphenyl)-4-methyl-5-(3-pyridyl)-2-pyrazolin-3-one Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2C(=O)C(C(=N2)C3=CN=CC=C3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2C(=O)C(C(=N2)C3=CN=CC=C3)C

InChI

InChI=1S/C19H21N3O2/c1-3-4-12-24-17-9-7-16(8-10-17)22-19(23)14(2)18(21-22)15-6-5-11-20-13-15/h5-11,13-14H,3-4,12H2,1-2H3