5-bromanyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)furan-2-carboxamide Openeye Name: 5-bromo-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)furan-2-carboxamide CAS Name: 5-bromo-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)-2-furancarboxamide IUPAC Name: 5-bromo-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)furan-2-carboxamide Traditional Name: 5-bromo-N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-7-yl)-2-furamide Formula: C17H17BrN2O4 MolecularWeight: 393.23188

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)Br)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)Br)N(C1=O)C)C

InChI

InChI=1S/C17H17BrN2O4/c1-17(2)9-23-12-5-4-10(8-11(12)20(3)16(17)22)19-15(21)13-6-7-14(18)24-13/h4-8H,9H2,1-3H3,(H,19,21)