N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-methyl-benzenesulfonamide Formula: C14H10F3N3O6S MolecularWeight: 405.30591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10F3N3O6S/c1-8-2-4-10(5-3-8)27(25,26)18-13-11(19(21)22)6-9(14(15,16)17)7-12(13)20(23)24/h2-7,18H,1H3