[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone Openeye Name: [4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone CAS Name: [4-(4-methyl-3-nitrophenyl)sulfonyl-1-piperazinyl]-[2-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-(4-methyl-3-nitrophenyl)sulfonylpiperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone Traditional Name: [4-(4-methyl-3-nitro-phenyl)sulfonylpiperazino]-[2-(trifluoromethyl)phenyl]methanone Formula: C19H18F3N3O5S MolecularWeight: 457.42353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H18F3N3O5S/c1-13-6-7-14(12-17(13)25(27)28)31(29,30)24-10-8-23(9-11-24)18(26)15-4-2-3-5-16(15)19(20,21)22/h2-7,12H,8-11H2,1H3