4-(4-ethanoylpiperazin-1-yl)-N-methyl-3-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-methyl-3-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-methyl-3-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-methyl-3-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-methyl-3-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide Traditional Name: 4-(4-acetylpiperazino)-N-methyl-3-nitro-N-[4-(trifluoromethyl)benzyl]benzamide Formula: C22H23F3N4O4 MolecularWeight: 464.43763

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H23F3N4O4/c1-15(30)27-9-11-28(12-10-27)19-8-5-17(13-20(19)29(32)33)21(31)26(2)14-16-3-6-18(7-4-16)22(23,24)25/h3-8,13H,9-12,14H2,1-2H3