N-(2-methyl-6-nitro-phenyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanamide Openeye Name: N-(2-methyl-6-nitro-phenyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetamide CAS Name: N-(2-methyl-6-nitrophenyl)-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-methyl-6-nitrophenyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetamide Traditional Name: N-(2-methyl-6-nitro-phenyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazino]acetamide Formula: C20H21F3N4O3 MolecularWeight: 422.40095

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H21F3N4O3/c1-14-4-2-7-17(27(29)30)19(14)24-18(28)13-25-8-10-26(11-9-25)16-6-3-5-15(12-16)20(21,22)23/h2-7,12H,8-11,13H2,1H3,(H,24,28)