1-(2-methyl-5-nitro-phenyl)sulfonyl-4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazine

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-4-[[4-(trifluoromethyloxy)phenyl]methyl]piperazine Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-4-[[4-(trifluoromethoxy)phenyl]methyl]piperazine CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-4-[[4-(trifluoromethoxy)phenyl]methyl]piperazine IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-4-[[4-(trifluoromethoxy)phenyl]methyl]piperazine Traditional Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-4-[4-(trifluoromethoxy)benzyl]piperazine Formula: C19H20F3N3O5S MolecularWeight: 459.43941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H20F3N3O5S/c1-14-2-5-16(25(26)27)12-18(14)31(28,29)24-10-8-23(9-11-24)13-15-3-6-17(7-4-15)30-19(20,21)22/h2-7,12H,8-11,13H2,1H3