3-[(3-nitropyridin-2-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 3-[(3-nitropyridin-2-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 3-[(3-nitro-2-pyridyl)amino]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 3-[(3-nitro-2-pyridinyl)amino]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 3-[(3-nitropyridin-2-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 3-[(3-nitro-2-pyridyl)amino]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C18H13F3N4O4S MolecularWeight: 438.38043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)NC3=C(C=CC=N3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)NC3=C(C=CC=N3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C18H13F3N4O4S/c19-18(20,21)12-4-1-6-14(10-12)24-30(28,29)15-7-2-5-13(11-15)23-17-16(25(26)27)8-3-9-22-17/h1-11,24H,(H,22,23)