N-[[5-methyl-2-(trifluoromethyl)furan-3-yl]methyl]-6-morpholin-4-yl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-[[5-methyl-2-(trifluoromethyl)furan-3-yl]methyl]-6-morpholin-4-yl-pyridin-1-ium-3-sulfonamide Openeye Name: N-[[5-methyl-2-(trifluoromethyl)-3-furyl]methyl]-6-morpholino-pyridin-1-ium-3-sulfonamide CAS Name: N-[[5-methyl-2-(trifluoromethyl)-3-furanyl]methyl]-6-(4-morpholinyl)-3-pyridin-1-iumsulfonamide IUPAC Name: N-[[5-methyl-2-(trifluoromethyl)furan-3-yl]methyl]-6-morpholin-4-ylpyridin-1-ium-3-sulfonamide Traditional Name: N-[[5-methyl-2-(trifluoromethyl)-3-furyl]methyl]-6-morpholino-pyridin-1-ium-3-sulfonamide Formula: C16H19F3N3O4S+ MolecularWeight: 406.39997

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C(F)(F)F)CNS(=O)(=O)C2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(O1)C(F)(F)F)CNS(=O)(=O)C2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C16H18F3N3O4S/c1-11-8-12(15(26-11)16(17,18)19)9-21-27(23,24)13-2-3-14(20-10-13)22-4-6-25-7-5-22/h2-3,8,10,21H,4-7,9H2,1H3/p+1