(4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)methylene]isoquinoline-1,3-dione CAS Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-4-(3-nitrobenzylidene)-2-piperonyl-isoquinoline-1,3-quinone Formula: C24H16N2O6 MolecularWeight: 428.39364

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4C(=CC5=CC(=CC=C5)[N+](=O)[O-])C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4/C(=C\C5=CC(=CC=C5)[N+](=O)[O-])/C3=O

InChI

InChI=1S/C24H16N2O6/c27-23-19-7-2-1-6-18(19)20(11-15-4-3-5-17(10-15)26(29)30)24(28)25(23)13-16-8-9-21-22(12-16)32-14-31-21/h1-12H,13-14H2/b20-11+