6-bromanyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-quinolin-2-amine

Systemtic Name: 6-bromanyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-quinolin-2-amine Openeye Name: 6-bromo-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-quinolin-2-amine CAS Name: 6-bromo-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-2-quinolinamine IUPAC Name: 6-bromo-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenylquinolin-2-amine Traditional Name: (6-bromo-4-phenyl-2-quinolyl)-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]amine Formula: C23H15BrN4O4 MolecularWeight: 491.2936

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC3=NC4=C(C=C(C=C4)Br)C(=C3)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/NC3=NC4=C(C=C(C=C4)Br)C(=C3)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H15BrN4O4/c24-16-6-7-19-18(9-16)17(14-4-2-1-3-5-14)10-23(26-19)27-25-12-15-8-21-22(32-13-31-21)11-20(15)28(29)30/h1-12H,13H2,(H,26,27)/b25-12+