(4-ethylpiperazin-1-yl)-[2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methanone

Systemtic Name: (4-ethylpiperazin-1-yl)-[2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methanone Openeye Name: (4-ethylpiperazin-1-yl)-[2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methanone CAS Name: (4-ethyl-1-piperazinyl)-[2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methanone IUPAC Name: (4-ethylpiperazin-1-yl)-[2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methanone Traditional Name: (4-ethylpiperazino)-[2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methanone Formula: C20H20F3N3O4 MolecularWeight: 423.38571

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC=CC=C2OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC=CC=C2OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H20F3N3O4/c1-2-24-9-11-25(12-10-24)19(27)15-5-3-4-6-17(15)30-18-8-7-14(20(21,22)23)13-16(18)26(28)29/h3-8,13H,2,9-12H2,1H3