(E)-ethylidene-[3-[ethyl-(4-methylphenyl)sulfonyl-amino]-2-fluoranyl-propoxy]-methyl-azanium

Systemtic Name: (E)-ethylidene-[3-[ethyl-(4-methylphenyl)sulfonyl-amino]-2-fluoranyl-propoxy]-methyl-azanium Openeye Name: (E)-ethylidene-[3-[ethyl(p-tolylsulfonyl)amino]-2-fluoro-propoxy]-methyl-ammonium CAS Name: (E)-ethylidene-[3-[ethyl-(4-methylphenyl)sulfonylamino]-2-fluoropropoxy]-methylammonium IUPAC Name: (E)-ethylidene-[3-[ethyl-(4-methylphenyl)sulfonylamino]-2-fluoropropoxy]-methylazanium Traditional Name: (E)-ethylidene-[3-[ethyl(tosyl)amino]-2-fluoro-propoxy]-methyl-ammonium Formula: C15H24FN2O3S+ MolecularWeight: 331.426063

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(CO[N+](=CC)C)F)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCN(CC(CO/[N+](=C/C)/C)F)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C15H24FN2O3S/c1-5-17(4)21-12-14(16)11-18(6-2)22(19,20)15-9-7-13(3)8-10-15/h5,7-10,14H,6,11-12H2,1-4H3/q+1/b17-5+