4-chloranyl-3-nitro-N-[3-[[3-(trifluoromethyl)phenyl]amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-3-nitro-N-[3-[[3-(trifluoromethyl)phenyl]amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-chloro-3-nitro-N-[3-[3-(trifluoromethyl)anilino]quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-chloro-3-nitro-N-[3-[3-(trifluoromethyl)anilino]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-chloro-3-nitro-N-[3-[3-(trifluoromethyl)anilino]quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-chloro-3-nitro-N-[3-[3-(trifluoromethyl)anilino]quinoxalin-2-yl]benzenesulfonamide Formula: C21H13ClF3N5O4S MolecularWeight: 523.87223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H13ClF3N5O4S/c22-15-9-8-14(11-18(15)30(31)32)35(33,34)29-20-19(27-16-6-1-2-7-17(16)28-20)26-13-5-3-4-12(10-13)21(23,24)25/h1-11H,(H,26,27)(H,28,29)