N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C17H15BrN2O7 MolecularWeight: 439.2142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(C=C2Br)OCCO3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(C=C2Br)OCCO3)[N+](=O)[O-])OC

InChI

InChI=1S/C17H15BrN2O7/c1-24-13-5-9(12(20(22)23)8-14(13)25-2)17(21)19-11-7-16-15(6-10(11)18)26-3-4-27-16/h5-8H,3-4H2,1-2H3,(H,19,21)