1-benzofuran-3-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: 1-benzofuran-3-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: benzofuran-3-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: 3-benzofuranyl-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: 1-benzofuran-3-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: benzofuran-3-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C20H16F3N3O4 MolecularWeight: 419.35395

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=COC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=COC4=CC=CC=C43

InChI

InChI=1S/C20H16F3N3O4/c21-20(22,23)13-5-6-16(17(11-13)26(28)29)24-7-9-25(10-8-24)19(27)15-12-30-18-4-2-1-3-14(15)18/h1-6,11-12H,7-10H2