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

Systemtic Name: 4,5-dimethoxy-2-nitro-N-(5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzamide Traditional Name: N-(5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C18H17N3O7 MolecularWeight: 387.34348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(C=C2)OCCNC3=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(C=C2)OCCNC3=O)[N+](=O)[O-])OC

InChI

InChI=1S/C18H17N3O7/c1-26-15-8-11(13(21(24)25)9-16(15)27-2)18(23)20-10-3-4-14-12(7-10)17(22)19-5-6-28-14/h3-4,7-9H,5-6H2,1-2H3,(H,19,22)(H,20,23)