4-[[3,4-bis(fluoranyl)phenyl]methyl]thiomorpholin-4-ium

Systemtic Name: 4-[[3,4-bis(fluoranyl)phenyl]methyl]thiomorpholin-4-ium Openeye Name: 4-[(3,4-difluorophenyl)methyl]thiomorpholin-4-ium CAS Name: 4-[(3,4-difluorophenyl)methyl]thiomorpholin-4-ium IUPAC Name: 4-[(3,4-difluorophenyl)methyl]thiomorpholin-4-ium Traditional Name: 4-(3,4-difluorobenzyl)thiomorpholin-4-ium Formula: C11H14F2NS+ MolecularWeight: 230.297366

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1CC2=CC(=C(C=C2)F)F

Isomeric SMILES

C1CSCC[NH+]1CC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C11H13F2NS/c12-10-2-1-9(7-11(10)13)8-14-3-5-15-6-4-14/h1-2,7H,3-6,8H2/p+1