3-bromanyl-N-(3,3-dimethyl-5-oxidanylidene-2,4-dihydro-1,4-benzoxazepin-7-yl)benzamide

Systemtic Name: 3-bromanyl-N-(3,3-dimethyl-5-oxidanylidene-2,4-dihydro-1,4-benzoxazepin-7-yl)benzamide Openeye Name: 3-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)benzamide CAS Name: 3-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)benzamide IUPAC Name: 3-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)benzamide Traditional Name: 3-bromo-N-(5-keto-3,3-dimethyl-2,4-dihydro-1,4-benzoxazepin-7-yl)benzamide Formula: C18H17BrN2O3 MolecularWeight: 389.24318

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)C(=O)N1)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)C(=O)N1)C

InChI

InChI=1S/C18H17BrN2O3/c1-18(2)10-24-15-7-6-13(9-14(15)17(23)21-18)20-16(22)11-4-3-5-12(19)8-11/h3-9H,10H2,1-2H3,(H,20,22)(H,21,23)