5-[4-(1-phenylpyrazol-4-yl)-1,2-dihydropyrazol-3-ylidene]-1,3-benzodioxol-4-one

Systemtic Name: 5-[4-(1-phenylpyrazol-4-yl)-1,2-dihydropyrazol-3-ylidene]-1,3-benzodioxol-4-one Openeye Name: 5-[4-(1-phenylpyrazol-4-yl)-1,2-dihydropyrazol-3-ylidene]-1,3-benzodioxol-4-one CAS Name: 5-[4-(1-phenyl-4-pyrazolyl)-1,2-dihydropyrazol-3-ylidene]-1,3-benzodioxol-4-one IUPAC Name: 5-[4-(1-phenylpyrazol-4-yl)-1,2-dihydropyrazol-3-ylidene]-1,3-benzodioxol-4-one Traditional Name: 5-[4-(1-phenylpyrazol-4-yl)-3-pyrazolin-3-ylidene]-1,3-benzodioxol-4-one Formula: C19H14N4O3 MolecularWeight: 346.33946

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=O)C(=C3C(=CNN3)C4=CN(N=C4)C5=CC=CC=C5)C=C2

Isomeric SMILES

C1OC2=C(O1)C(=O)C(=C3C(=CNN3)C4=CN(N=C4)C5=CC=CC=C5)C=C2

InChI

InChI=1S/C19H14N4O3/c24-18-14(6-7-16-19(18)26-11-25-16)17-15(9-20-22-17)12-8-21-23(10-12)13-4-2-1-3-5-13/h1-10,20,22H,11H2