[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone Openeye Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone CAS Name: [4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-[4-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone Traditional Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-[4-(trifluoromethyl)phenyl]methanone Formula: C19H18F3N3O6S MolecularWeight: 473.42293

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18F3N3O6S/c1-31-17-7-6-15(12-16(17)25(27)28)32(29,30)24-10-8-23(9-11-24)18(26)13-2-4-14(5-3-13)19(20,21)22/h2-7,12H,8-11H2,1H3