3-[(4-fluorophenyl)methyl-methylsulfonyl-amino]propanoate

Systemtic Name: 3-[(4-fluorophenyl)methyl-methylsulfonyl-amino]propanoate Openeye Name: 3-[(4-fluorophenyl)methyl-methylsulfonyl-amino]propanoate CAS Name: 3-[(4-fluorophenyl)methyl-methylsulfonylamino]propanoate IUPAC Name: 3-[(4-fluorophenyl)methyl-methylsulfonylamino]propanoate Traditional Name: 3-[(4-fluorobenzyl)-mesyl-amino]propionate Formula: C11H13FNO4S- MolecularWeight: 274.288623

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCC(=O)[O-])CC1=CC=C(C=C1)F

Isomeric SMILES

CS(=O)(=O)N(CCC(=O)[O-])CC1=CC=C(C=C1)F

InChI

InChI=1S/C11H14FNO4S/c1-18(16,17)13(7-6-11(14)15)8-9-2-4-10(12)5-3-9/h2-5H,6-8H2,1H3,(H,14,15)/p-1