5-acetamido-2,4,6-tris(bromanyl)-N3-(2,2-dimethyl-6-oxidanyl-1,3-dioxepin-5-yl)benzene-1,3-dicarboxamide

Systemtic Name: 5-acetamido-2,4,6-tris(bromanyl)-N3-(2,2-dimethyl-6-oxidanyl-1,3-dioxepin-5-yl)benzene-1,3-dicarboxamide Openeye Name: 5-acetamido-2,4,6-tribromo-N3-(6-hydroxy-2,2-dimethyl-1,3-dioxepin-5-yl)benzene-1,3-dicarboxamide CAS Name: 5-acetamido-2,4,6-tribromo-N3-(6-hydroxy-2,2-dimethyl-1,3-dioxepin-5-yl)benzene-1,3-dicarboxamide IUPAC Name: 5-acetamido-2,4,6-tribromo-3-N-(6-hydroxy-2,2-dimethyl-1,3-dioxepin-5-yl)benzene-1,3-dicarboxamide Traditional Name: 5-acetamido-2,4,6-tribromo-N'-(6-hydroxy-2,2-dimethyl-1,3-dioxepin-5-yl)isophthalamide Formula: C17H16Br3N3O6 MolecularWeight: 598.03744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=C(C(=C1Br)C(=O)NC2=COC(OC=C2O)(C)C)Br)C(=O)N)Br

Isomeric SMILES

CC(=O)NC1=C(C(=C(C(=C1Br)C(=O)NC2=COC(OC=C2O)(C)C)Br)C(=O)N)Br

InChI

InChI=1S/C17H16Br3N3O6/c1-6(24)22-14-12(19)9(15(21)26)11(18)10(13(14)20)16(27)23-7-4-28-17(2,3)29-5-8(7)25/h4-5,25H,1-3H3,(H2,21,26)(H,22,24)(H,23,27)