N-[2-(4-bromophenyl)-1,3-benzoxazol-6-yl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine

Systemtic Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-6-yl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Openeye Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-6-yl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine CAS Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-6-yl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine IUPAC Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-6-yl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Traditional Name: [2-(4-bromophenyl)-1,3-benzoxazol-6-yl]-[(6-nitro-1,3-benzodioxol-5-yl)methylene]amine Formula: C21H12BrN3O5 MolecularWeight: 466.24108

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NC3=CC4=C(C=C3)N=C(O4)C5=CC=C(C=C5)Br)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=NC3=CC4=C(C=C3)N=C(O4)C5=CC=C(C=C5)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H12BrN3O5/c22-14-3-1-12(2-4-14)21-24-16-6-5-15(8-18(16)30-21)23-10-13-7-19-20(29-11-28-19)9-17(13)25(26)27/h1-10H,11H2