2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C17H11BrN2O6 MolecularWeight: 419.18304

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11BrN2O6/c18-13-7-15-14(25-3-4-26-15)5-9(13)8-19-16(21)11-2-1-10(20(23)24)6-12(11)17(19)22/h1-2,5-7H,3-4,8H2