2-(1,3-benzodioxol-5-yl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-7-nitro-1,2-dihydroquinazolin-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-7-nitro-1,2-dihydroquinazolin-4-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-7-nitro-1,2-dihydroquinazolin-4-one CAS Name: 2-(1,3-benzodioxol-5-yl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-7-nitro-1,2-dihydroquinazolin-4-one IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-7-nitro-1,2-dihydroquinazolin-4-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-7-nitro-3-[(E)-piperonylideneamino]-1,2-dihydroquinazolin-4-one Formula: C23H16N4O7 MolecularWeight: 460.39574

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NN3C(NC4=C(C3=O)C=CC(=C4)[N+](=O)[O-])C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/N3C(NC4=C(C3=O)C=CC(=C4)[N+](=O)[O-])C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C23H16N4O7/c28-23-16-4-3-15(27(29)30)9-17(16)25-22(14-2-6-19-21(8-14)34-12-32-19)26(23)24-10-13-1-5-18-20(7-13)33-11-31-18/h1-10,22,25H,11-12H2/b24-10+