2-(hydroxymethyl)-2-methyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one

Systemtic Name: 2-(hydroxymethyl)-2-methyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one Openeye Name: 2-(hydroxymethyl)-2-methyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one CAS Name: 2-(hydroxymethyl)-2-methyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one IUPAC Name: 2-(hydroxymethyl)-2-methyl-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one Traditional Name: 2-methyl-2-methylol-7,9-dinitro-1,3-dihydro-4,1-benzoxazepin-5-one Formula: C11H11N3O7 MolecularWeight: 297.22094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O7/c1-11(4-15)5-21-10(16)7-2-6(13(17)18)3-8(14(19)20)9(7)12-11/h2-3,12,15H,4-5H2,1H3