4-oxidanyl-6,8-bis(trifluoromethyl)-1H-1-benzazepine-2,3-dione

Systemtic Name: 4-oxidanyl-6,8-bis(trifluoromethyl)-1H-1-benzazepine-2,3-dione Openeye Name: 4-hydroxy-6,8-bis(trifluoromethyl)-1H-1-benzazepine-2,3-dione CAS Name: 4-hydroxy-6,8-bis(trifluoromethyl)-1H-1-benzazepine-2,3-dione IUPAC Name: 4-hydroxy-6,8-bis(trifluoromethyl)-1H-1-benzazepine-2,3-dione Traditional Name: 4-hydroxy-6,8-bis(trifluoromethyl)-1H-1-benzazepine-2,3-quinone Formula: C12H5F6NO3 MolecularWeight: 325.163419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1C(F)(F)F)C=C(C(=O)C(=O)N2)O)C(F)(F)F

Isomeric SMILES

C1=C(C=C2C(=C1C(F)(F)F)C=C(C(=O)C(=O)N2)O)C(F)(F)F

InChI

InChI=1S/C12H5F6NO3/c13-11(14,15)4-1-6(12(16,17)18)5-3-8(20)9(21)10(22)19-7(5)2-4/h1-3H,(H2,19,20,21,22)