1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Formula: C20H20F3N3O4 MolecularWeight: 423.38571

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H20F3N3O4/c21-20(22,23)15-2-3-16(17(12-15)26(27)28)25-7-5-24(6-8-25)13-14-1-4-18-19(11-14)30-10-9-29-18/h1-4,11-12H,5-10,13H2