5-[2-(4-nitroimidazol-1-yl)ethanoyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-(4-nitroimidazol-1-yl)ethanoyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(4-nitroimidazol-1-yl)acetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-(4-nitro-1-imidazolyl)-1-oxoethyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(4-nitroimidazol-1-yl)acetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-(4-nitroimidazol-1-yl)acetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C15H12F3N5O4 MolecularWeight: 383.28209

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C2NC1=O)C(=O)CN3C=C(N=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1C(N(C2=CC=CC=C2NC1=O)C(=O)CN3C=C(N=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H12F3N5O4/c16-15(17,18)11-5-13(24)20-9-3-1-2-4-10(9)22(11)14(25)7-21-6-12(19-8-21)23(26)27/h1-4,6,8,11H,5,7H2,(H,20,24)