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

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-(4-nitrophenyl)-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-(4-nitrophenyl)-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-(4-nitrophenyl)-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-(4-nitrophenyl)-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-(4-nitrophenyl)-2-phenyl-4-piperonylidene-2-pyrazolin-3-one Formula: C23H15N3O5 MolecularWeight: 413.3823

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H15N3O5/c27-23-19(12-15-6-11-20-21(13-15)31-14-30-20)22(16-7-9-18(10-8-16)26(28)29)24-25(23)17-4-2-1-3-5-17/h1-13H,14H2/b19-12-