2-[4-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]piperazine-1,4-diium-1-yl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[4-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]piperazine-1,4-diium-1-yl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]piperazine-1,4-diium-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-1-piperazine-1,4-diiumyl]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]piperazine-1,4-diium-1-yl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-[4-(difluoromethoxy)-3-methoxy-benzyl]piperazine-1,4-diium-1-yl]-N-(3-fluorophenyl)acetamide Formula: C21H26F3N3O3+2 MolecularWeight: 425.44465

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F)OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F)OC(F)F

InChI

InChI=1S/C21H24F3N3O3/c1-29-19-11-15(5-6-18(19)30-21(23)24)13-26-7-9-27(10-8-26)14-20(28)25-17-4-2-3-16(22)12-17/h2-6,11-12,21H,7-10,13-14H2,1H3,(H,25,28)/p+2