N-(3,5-dimethoxyphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline Openeye Name: N-(3,5-dimethoxyphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline CAS Name: N-(3,5-dimethoxyphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline IUPAC Name: N-(3,5-dimethoxyphenyl)-2-nitro-4-(trifluoromethylsulfonyl)aniline Traditional Name: (3,5-dimethoxyphenyl)-(2-nitro-4-triflyl-phenyl)amine Formula: C15H13F3N2O6S MolecularWeight: 406.33373

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])OC

InChI

InChI=1S/C15H13F3N2O6S/c1-25-10-5-9(6-11(7-10)26-2)19-13-4-3-12(8-14(13)20(21)22)27(23,24)15(16,17)18/h3-8,19H,1-2H3