4-(dipropylamino)-3,5-dinitro-N-(trifluoromethylsulfonyl)benzenesulfonamide

Systemtic Name: 4-(dipropylamino)-3,5-dinitro-N-(trifluoromethylsulfonyl)benzenesulfonamide Openeye Name: 4-(dipropylamino)-3,5-dinitro-N-(trifluoromethylsulfonyl)benzenesulfonamide CAS Name: 4-(dipropylamino)-3,5-dinitro-N-(trifluoromethylsulfonyl)benzenesulfonamide IUPAC Name: 4-(dipropylamino)-3,5-dinitro-N-(trifluoromethylsulfonyl)benzenesulfonamide Traditional Name: 4-(dipropylamino)-3,5-dinitro-N-triflyl-benzenesulfonamide Formula: C13H17F3N4O8S2 MolecularWeight: 478.42129

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H17F3N4O8S2/c1-3-5-18(6-4-2)12-10(19(21)22)7-9(8-11(12)20(23)24)29(25,26)17-30(27,28)13(14,15)16/h7-8,17H,3-6H2,1-2H3