7-bromanyl-8-nitro-5-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-8-nitro-5-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 7-bromo-8-nitro-5-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 7-bromo-8-nitro-5-(2,2,2-trifluoro-1-oxoethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 7-bromo-8-nitro-5-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 7-bromo-8-nitro-5-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C11H7BrF3N3O4 MolecularWeight: 382.09019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])Br)C(=O)C(F)(F)F

Isomeric SMILES

C1CN(C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])Br)C(=O)C(F)(F)F

InChI

InChI=1S/C11H7BrF3N3O4/c12-5-3-8-6(4-7(5)18(21)22)16-9(19)1-2-17(8)10(20)11(13,14)15/h3-4H,1-2H2,(H,16,19)