2-bromanyl-N-(3-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-(3-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-5-methoxy-benzamide Openeye Name: 2-bromo-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-5-methoxy-benzamide CAS Name: 2-bromo-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-5-methoxybenzamide IUPAC Name: 2-bromo-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-5-methoxybenzamide Traditional Name: 2-bromo-N-(3-chloro-6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl)-5-methoxy-benzamide Formula: C21H14BrClN2O4 MolecularWeight: 473.70386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)Cl)NC3=O

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)Cl)NC3=O

InChI

InChI=1S/C21H14BrClN2O4/c1-28-13-4-5-16(22)14(10-13)20(26)24-12-3-7-18-15(9-12)21(27)25-17-8-11(23)2-6-19(17)29-18/h2-10H,1H3,(H,24,26)(H,25,27)