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

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-methyl-2-phenyl-4-piperonylidene-2-pyrazolin-3-one Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O3/c1-12-15(9-13-7-8-16-17(10-13)23-11-22-16)18(21)20(19-12)14-5-3-2-4-6-14/h2-10H,11H2,1H3/b15-9-