2-methyl-3-nitro-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)benzamide

Systemtic Name: 2-methyl-3-nitro-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)benzamide Openeye Name: 2-methyl-3-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)benzamide CAS Name: 2-methyl-3-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)benzamide IUPAC Name: 2-methyl-3-nitro-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)benzamide Traditional Name: N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-8-yl)-2-methyl-3-nitro-benzamide Formula: C20H21N3O5 MolecularWeight: 383.39784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)C

InChI

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