2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[2-furylmethyl(p-tolylsulfonyl)amino]acetic acid CAS Name: 2-[2-furanylmethyl-(4-methylphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[2-furfuryl(tosyl)amino]acetic acid Formula: C14H15NO5S MolecularWeight: 309.3376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)O

InChI

InChI=1S/C14H15NO5S/c1-11-4-6-13(7-5-11)21(18,19)15(10-14(16)17)9-12-3-2-8-20-12/h2-8H,9-10H2,1H3,(H,16,17)