1-(4-methoxy-3-nitro-phenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine

Systemtic Name: 1-(4-methoxy-3-nitro-phenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine Openeye Name: 1-(4-methoxy-3-nitro-phenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine CAS Name: 1-(4-methoxy-3-nitrophenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine IUPAC Name: 1-(4-methoxy-3-nitrophenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine Traditional Name: 1-(4-methoxy-3-nitro-phenyl)sulfonyl-4-[4-(trifluoromethyl)benzyl]piperazine Formula: C19H20F3N3O5S MolecularWeight: 459.43941

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

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