4-(4-bromanylbutyl)-6-imidazol-1-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione

Systemtic Name: 4-(4-bromanylbutyl)-6-imidazol-1-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione Openeye Name: 4-(4-bromobutyl)-6-imidazol-1-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione CAS Name: 4-(4-bromobutyl)-6-(1-imidazolyl)-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione IUPAC Name: 4-(4-bromobutyl)-6-imidazol-1-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-dione Traditional Name: 4-(4-bromobutyl)-6-imidazol-1-yl-7-(trifluoromethyl)-1H-quinoxaline-2,3-quinone Formula: C16H14BrF3N4O2 MolecularWeight: 431.20717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C2=CC3=C(C=C2C(F)(F)F)NC(=O)C(=O)N3CCCCBr

Isomeric SMILES

C1=CN(C=N1)C2=CC3=C(C=C2C(F)(F)F)NC(=O)C(=O)N3CCCCBr

InChI

InChI=1S/C16H14BrF3N4O2/c17-3-1-2-5-24-13-8-12(23-6-4-21-9-23)10(16(18,19)20)7-11(13)22-14(25)15(24)26/h4,6-9H,1-3,5H2,(H,22,25)