2-[4-(3-methyl-2-nitro-phenyl)carbonylpiperazin-1-yl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide

Systemtic Name: 2-[4-(3-methyl-2-nitro-phenyl)carbonylpiperazin-1-yl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide Openeye Name: 2-[4-(3-methyl-2-nitro-benzoyl)piperazin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide CAS Name: 2-[4-[(3-methyl-2-nitrophenyl)-oxomethyl]-1-piperazinyl]-N-[4-(trifluoromethoxy)phenyl]acetamide IUPAC Name: 2-[4-(3-methyl-2-nitrobenzoyl)piperazin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide Traditional Name: 2-[4-(3-methyl-2-nitro-benzoyl)piperazino]-N-[4-(trifluoromethoxy)phenyl]acetamide Formula: C21H21F3N4O5 MolecularWeight: 466.41045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H21F3N4O5/c1-14-3-2-4-17(19(14)28(31)32)20(30)27-11-9-26(10-12-27)13-18(29)25-15-5-7-16(8-6-15)33-21(22,23)24/h2-8H,9-13H2,1H3,(H,25,29)