4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-2-methyl-5-pyridin-4-yl-4H-pyrazol-3-one

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-2-methyl-5-pyridin-4-yl-4H-pyrazol-3-one Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-2-methyl-5-(4-pyridyl)-4H-pyrazol-3-one CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-2-methyl-5-pyridin-4-yl-4H-pyrazol-3-one IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-2-methyl-5-pyridin-4-yl-4H-pyrazol-3-one Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-2-methyl-5-(4-pyridyl)-2-pyrazolin-3-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=N1)C2=CC=NC=C2)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN1C(=O)C(C(=N1)C2=CC=NC=C2)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H15N3O4/c1-21-18(23)15(16(20-21)11-4-6-19-7-5-11)17(22)12-2-3-13-14(10-12)25-9-8-24-13/h2-7,10,15H,8-9H2,1H3