7,9-dinitro-1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one

Systemtic Name: 7,9-dinitro-1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one Openeye Name: 7,9-dinitro-1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one CAS Name: 7,9-dinitro-1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one IUPAC Name: 7,9-dinitro-1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one Traditional Name: 7,9-dinitro-1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one Formula: C9H8N4O5 MolecularWeight: 252.18362

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=CC(=CC(=C2N1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CNC(=O)C2=CC(=CC(=C2N1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H8N4O5/c14-9-6-3-5(12(15)16)4-7(13(17)18)8(6)10-1-2-11-9/h3-4,10H,1-2H2,(H,11,14)