N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-2-methoxy-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-2-methoxy-4-nitro-benzenesulfonamide Openeye Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]-2-methoxy-4-nitro-benzenesulfonamide CAS Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-2-methoxy-4-nitrobenzenesulfonamide IUPAC Name: N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-2-methoxy-4-nitrobenzenesulfonamide Traditional Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]-2-methoxy-4-nitro-benzenesulfonamide Formula: C15H14ClF3N4O5S MolecularWeight: 454.80867

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)NCCNC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)NCCNC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C15H14ClF3N4O5S/c1-28-12-7-10(23(24)25)2-3-13(12)29(26,27)22-5-4-20-14-11(16)6-9(8-21-14)15(17,18)19/h2-3,6-8,22H,4-5H2,1H3,(H,20,21)