N-(2-dimethylaminoethyl)-3-nitro-4-[2-[4-(trifluoromethyl)phenyl]ethylamino]benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-3-nitro-4-[2-[4-(trifluoromethyl)phenyl]ethylamino]benzenesulfonamide Openeye Name: N-(2-dimethylaminoethyl)-3-nitro-4-[2-[4-(trifluoromethyl)phenyl]ethylamino]benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-3-nitro-4-[2-[4-(trifluoromethyl)phenyl]ethylamino]benzenesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-3-nitro-4-[2-[4-(trifluoromethyl)phenyl]ethylamino]benzenesulfonamide Traditional Name: N-(2-dimethylaminoethyl)-3-nitro-4-[2-[4-(trifluoromethyl)phenyl]ethylamino]benzenesulfonamide Formula: C19H23F3N4O4S MolecularWeight: 460.47053

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H23F3N4O4S/c1-25(2)12-11-24-31(29,30)16-7-8-17(18(13-16)26(27)28)23-10-9-14-3-5-15(6-4-14)19(20,21)22/h3-8,13,23-24H,9-12H2,1-2H3