(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-methyl-2-pyridin-2-yl-pyrazol-3-one

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-methyl-2-pyridin-2-yl-pyrazol-3-one Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-methyl-2-(2-pyridyl)pyrazol-3-one CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-methyl-2-(2-pyridinyl)-3-pyrazolone IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-methyl-2-pyridin-2-ylpyrazol-3-one Traditional Name: (4Z)-5-methyl-4-piperonylidene-2-(2-pyridyl)-2-pyrazolin-3-one Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC3=C(C=C2)OCO3)C4=CC=CC=N4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC3=C(C=C2)OCO3)C4=CC=CC=N4

InChI

InChI=1S/C17H13N3O3/c1-11-13(8-12-5-6-14-15(9-12)23-10-22-14)17(21)20(19-11)16-4-2-3-7-18-16/h2-9H,10H2,1H3/b13-8-