4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide Formula: C19H20F3N4O3+ MolecularWeight: 409.38231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H19F3N4O3/c1-24-8-10-25(11-9-24)16-7-2-13(12-17(16)26(28)29)18(27)23-15-5-3-14(4-6-15)19(20,21)22/h2-7,12H,8-11H2,1H3,(H,23,27)/p+1