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

Systemtic Name: 4,5-dimethoxy-2-nitro-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)benzamide Traditional Name: N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)N(C1=O)C)C

InChI

InChI=1S/C21H23N3O7/c1-21(2)11-31-16-7-6-12(8-15(16)23(3)20(21)26)22-19(25)13-9-17(29-4)18(30-5)10-14(13)24(27)28/h6-10H,11H2,1-5H3,(H,22,25)