3-nitro-6,8-bis(trifluoromethyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione

Systemtic Name: 3-nitro-6,8-bis(trifluoromethyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione Openeye Name: 3-nitro-6,8-bis(trifluoromethyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione CAS Name: 3-nitro-6,8-bis(trifluoromethyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione IUPAC Name: 3-nitro-6,8-bis(trifluoromethyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione Traditional Name: 3-nitro-6,8-bis(trifluoromethyl)-1,5-dihydro-1,5-benzodiazepine-2,4-quinone Formula: C11H5F6N3O4 MolecularWeight: 357.165519

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1C(F)(F)F)NC(=O)C(C(=O)N2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=C(C=C2C(=C1C(F)(F)F)NC(=O)C(C(=O)N2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C11H5F6N3O4/c12-10(13,14)3-1-4(11(15,16)17)6-5(2-3)18-8(21)7(20(23)24)9(22)19-6/h1-2,7H,(H,18,21)(H,19,22)