2-chloranyl-5-nitro-N-(5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide

Systemtic Name: 2-chloranyl-5-nitro-N-(5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide Openeye Name: 2-chloro-5-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide CAS Name: 2-chloro-5-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide IUPAC Name: 2-chloro-5-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide Traditional Name: 2-chloro-N-(5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-5-nitro-benzamide Formula: C16H12ClN3O5 MolecularWeight: 361.73658

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)N1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)N1

InChI

InChI=1S/C16H12ClN3O5/c17-13-3-2-10(20(23)24)8-11(13)16(22)19-9-1-4-14-12(7-9)15(21)18-5-6-25-14/h1-4,7-8H,5-6H2,(H,18,21)(H,19,22)