2-methyl-N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 2-methyl-N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 2-methyl-N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: 2-methyl-N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: 2-methyl-N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]ethyl]-2-methyl-benzamide Formula: C21H21F3N4O4 MolecularWeight: 450.41105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H21F3N4O4/c1-14-4-2-3-5-16(14)20(30)25-13-19(29)27-10-8-26(9-11-27)17-7-6-15(21(22,23)24)12-18(17)28(31)32/h2-7,12H,8-11,13H2,1H3,(H,25,30)