2,2-dimethyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one

Systemtic Name: 2,2-dimethyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one Openeye Name: 2,2-dimethyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one CAS Name: 2,2-dimethyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one IUPAC Name: 2,2-dimethyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one Traditional Name: 2,2-dimethyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one Formula: C11H11N3O6 MolecularWeight: 281.22154

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=O)C2=CC(=CC(=C2N1)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1(COC(=O)C2=CC(=CC(=C2N1)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C11H11N3O6/c1-11(2)5-20-10(15)7-3-6(13(16)17)4-8(14(18)19)9(7)12-11/h3-4,12H,5H2,1-2H3