2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]-1-(4-phenylpiperazino)ethanone Formula: C23H26F3N5O3 MolecularWeight: 477.47945

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)N2CCN(CC2)C3=CC=CC=C3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)N2CCN(CC2)C3=CC=CC=C3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H26F3N5O3/c24-23(25,26)18-6-7-20(21(16-18)31(33)34)29-10-8-27(9-11-29)17-22(32)30-14-12-28(13-15-30)19-4-2-1-3-5-19/h1-7,16H,8-15,17H2