4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethyloxy)phenyl]methyl]aniline

Systemtic Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethyloxy)phenyl]methyl]aniline Openeye Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethoxy)phenyl]methyl]aniline CAS Name: 4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitro-N-[[4-(trifluoromethoxy)phenyl]methyl]aniline IUPAC Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethoxy)phenyl]methyl]aniline Traditional Name: [4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]-[4-(trifluoromethoxy)benzyl]amine Formula: C19H21F3N4O5S MolecularWeight: 474.45405

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=C(C=C3)OC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=C(C=C3)OC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H21F3N4O5S/c1-24-8-10-25(11-9-24)32(29,30)16-6-7-17(18(12-16)26(27)28)23-13-14-2-4-15(5-3-14)31-19(20,21)22/h2-7,12,23H,8-11,13H2,1H3