2-(2-bromanyl-4-methoxy-phenoxy)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanamide

Systemtic Name: 2-(2-bromanyl-4-methoxy-phenoxy)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanamide Openeye Name: 2-(2-bromo-4-methoxy-phenoxy)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]acetamide CAS Name: 2-(2-bromo-4-methoxyphenoxy)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]acetamide IUPAC Name: 2-(2-bromo-4-methoxyphenoxy)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]acetamide Traditional Name: 2-(2-bromo-4-methoxy-phenoxy)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]acetamide Formula: C17H14BrN3O7 MolecularWeight: 452.21296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)Br

Isomeric SMILES

COC1=CC(=C(C=C1)OCC(=O)N/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)Br

InChI

InChI=1S/C17H14BrN3O7/c1-25-11-2-3-14(12(18)5-11)26-8-17(22)20-19-7-10-4-15-16(28-9-27-15)6-13(10)21(23)24/h2-7H,8-9H2,1H3,(H,20,22)/b19-7+