3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-phenyl-quinazolin-4-one

Systemtic Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-phenyl-quinazolin-4-one Openeye Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-phenyl-quinazolin-4-one CAS Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-phenyl-4-quinazolinone IUPAC Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-phenylquinazolin-4-one Traditional Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-phenyl-quinazolin-4-one Formula: C22H14N4O5 MolecularWeight: 414.37036

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=NN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H14N4O5/c27-22-16-8-4-5-9-17(16)24-21(14-6-2-1-3-7-14)25(22)23-12-15-10-19-20(31-13-30-19)11-18(15)26(28)29/h1-12H,13H2