N-(4-acetamidophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(4-acetamidophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-(4-acetamidophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(4-acetamidophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(4-acetamidophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C17H15N3O6/c1-10(21)18-11-2-4-12(5-3-11)19-17(22)13-8-15-16(26-7-6-25-15)9-14(13)20(23)24/h2-5,8-9H,6-7H2,1H3,(H,18,21)(H,19,22)