3-[(5-methylfuran-2-yl)-(trifluoromethylsulfonyl)amino]propanoic acid

Systemtic Name: 3-[(5-methylfuran-2-yl)-(trifluoromethylsulfonyl)amino]propanoic acid Openeye Name: 3-[(5-methyl-2-furyl)-(trifluoromethylsulfonyl)amino]propanoic acid CAS Name: 3-[(5-methyl-2-furanyl)-(trifluoromethylsulfonyl)amino]propanoic acid IUPAC Name: 3-[(5-methylfuran-2-yl)-(trifluoromethylsulfonyl)amino]propanoic acid Traditional Name: 3-[(5-methyl-2-furyl)-triflyl-amino]propionic acid Formula: C9H10F3NO5S MolecularWeight: 301.23961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)N(CCC(=O)O)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=CC=C(O1)N(CCC(=O)O)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H10F3NO5S/c1-6-2-3-7(18-6)13(5-4-8(14)15)19(16,17)9(10,11)12/h2-3H,4-5H2,1H3,(H,14,15)