N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(6-bromanyl-1,3-benzodioxol-5-yl)methanimine

Systemtic Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(6-bromanyl-1,3-benzodioxol-5-yl)methanimine Openeye Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(6-bromo-1,3-benzodioxol-5-yl)methanimine CAS Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(6-bromo-1,3-benzodioxol-5-yl)methanimine IUPAC Name: N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(6-bromo-1,3-benzodioxol-5-yl)methanimine Traditional Name: [3-(1,3-benzoxazol-2-yl)phenyl]-[(6-bromo-1,3-benzodioxol-5-yl)methylene]amine Formula: C21H13BrN2O3 MolecularWeight: 421.24352

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NC3=CC=CC(=C3)C4=NC5=CC=CC=C5O4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=NC3=CC=CC(=C3)C4=NC5=CC=CC=C5O4)Br

InChI

InChI=1S/C21H13BrN2O3/c22-16-10-20-19(25-12-26-20)9-14(16)11-23-15-5-3-4-13(8-15)21-24-17-6-1-2-7-18(17)27-21/h1-11H,12H2