N-[4-bromanyl-2-(trifluoromethyl)phenyl]-5-tert-butyl-2-methyl-3-(4-nitrophenyl)sulfonyl-6-oxidanyl-benzamide

Systemtic Name: N-[4-bromanyl-2-(trifluoromethyl)phenyl]-5-tert-butyl-2-methyl-3-(4-nitrophenyl)sulfonyl-6-oxidanyl-benzamide Openeye Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-3-tert-butyl-2-hydroxy-6-methyl-5-(4-nitrophenyl)sulfonyl-benzamide CAS Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-3-tert-butyl-2-hydroxy-6-methyl-5-(4-nitrophenyl)sulfonylbenzamide IUPAC Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-3-tert-butyl-2-hydroxy-6-methyl-5-(4-nitrophenyl)sulfonylbenzamide Traditional Name: N-[4-bromo-2-(trifluoromethyl)phenyl]-3-tert-butyl-2-hydroxy-6-methyl-5-nosyl-benzamide Formula: C25H22BrF3N2O6S MolecularWeight: 615.41619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C(=O)NC2=C(C=C(C=C2)Br)C(F)(F)F)O)C(C)(C)C)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C(=C1C(=O)NC2=C(C=C(C=C2)Br)C(F)(F)F)O)C(C)(C)C)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H22BrF3N2O6S/c1-13-20(38(36,37)16-8-6-15(7-9-16)31(34)35)12-18(24(2,3)4)22(32)21(13)23(33)30-19-10-5-14(26)11-17(19)25(27,28)29/h5-12,32H,1-4H3,(H,30,33)