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

Systemtic Name: 3-methyl-4-nitro-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)benzamide Openeye Name: 3-methyl-4-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)benzamide CAS Name: 3-methyl-4-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)benzamide IUPAC Name: 3-methyl-4-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)-3-methyl-4-nitro-benzamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCC(C(=O)N3C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)OCC(C(=O)N3C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5/c1-12-9-13(5-7-15(12)23(26)27)18(24)21-14-6-8-17-16(10-14)22(4)19(25)20(2,3)11-28-17/h5-10H,11H2,1-4H3,(H,21,24)