(4-methyl-3-nitro-phenyl)-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]methanone

Systemtic Name: (4-methyl-3-nitro-phenyl)-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]methanone Openeye Name: (4-methyl-3-nitro-phenyl)-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]methanone CAS Name: (4-methyl-3-nitrophenyl)-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]methanone IUPAC Name: (4-methyl-3-nitrophenyl)-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]methanone Traditional Name: (4-methyl-3-nitro-phenyl)-[4-[2-(trifluoromethyl)benzoyl]piperazino]methanone Formula: C20H18F3N3O4 MolecularWeight: 421.36983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H18F3N3O4/c1-13-6-7-14(12-17(13)26(29)30)18(27)24-8-10-25(11-9-24)19(28)15-4-2-3-5-16(15)20(21,22)23/h2-7,12H,8-11H2,1H3