N-[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[4-(difluoromethoxy)-3-ethoxy-phenyl]-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[4-(difluoromethoxy)-3-ethoxy-phenyl]-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C19H24F2N3O5S2+ MolecularWeight: 476.537766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3)OC(F)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3)OC(F)F

InChI

InChI=1S/C19H23F2N3O5S2/c1-2-28-16-12-14(5-6-15(16)29-19(20)21)22-17(25)13-23-7-9-24(10-8-23)31(26,27)18-4-3-11-30-18/h3-6,11-12,19H,2,7-10,13H2,1H3,(H,22,25)/p+1