1-(3,4-dimethoxyphenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine Formula: C19H20F3N3O6S MolecularWeight: 475.43881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20F3N3O6S/c1-30-17-6-4-14(12-18(17)31-2)32(28,29)24-9-7-23(8-10-24)16-5-3-13(25(26)27)11-15(16)19(20,21)22/h3-6,11-12H,7-10H2,1-2H3