4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-[4-(trifluoromethyl)phenyl]ethyl]aniline

Systemtic Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-[4-(trifluoromethyl)phenyl]ethyl]aniline Openeye Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-[4-(trifluoromethyl)phenyl]ethyl]aniline CAS Name: 4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitro-N-[2-[4-(trifluoromethyl)phenyl]ethyl]aniline IUPAC Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-[4-(trifluoromethyl)phenyl]ethyl]aniline Traditional Name: [4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]-[2-[4-(trifluoromethyl)phenyl]ethyl]amine Formula: C20H23F3N4O4S MolecularWeight: 472.48123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H23F3N4O4S/c1-25-10-12-26(13-11-25)32(30,31)17-6-7-18(19(14-17)27(28)29)24-9-8-15-2-4-16(5-3-15)20(21,22)23/h2-7,14,24H,8-13H2,1H3