N-[[4-[bis(fluoranyl)methoxy]phenyl]methyl]-N-methyl-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]phenyl]methyl]-N-methyl-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-[[4-(difluoromethoxy)phenyl]methyl]-N-methyl-5-morpholinosulfonyl-pyridin-1-ium-2-amine CAS Name: N-[[4-(difluoromethoxy)phenyl]methyl]-N-methyl-5-(4-morpholinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[[4-(difluoromethoxy)phenyl]methyl]-N-methyl-5-morpholin-4-ylsulfonylpyridin-1-ium-2-amine Traditional Name: [4-(difluoromethoxy)benzyl]-methyl-(5-morpholinosulfonylpyridin-1-ium-2-yl)amine Formula: C18H22F2N3O4S+ MolecularWeight: 414.446786

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OC(F)F)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)OC(F)F)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H21F2N3O4S/c1-22(13-14-2-4-15(5-3-14)27-18(19)20)17-7-6-16(12-21-17)28(24,25)23-8-10-26-11-9-23/h2-7,12,18H,8-11,13H2,1H3/p+1