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3-[(3,4-dimethoxyphenyl)sulfonyl-(furan-2-ylmethyl)amino]propanoic acid
3-[(3,4-dimethoxyphenyl)sulfonyl-(furan-2-ylmethyl)amino]propanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C=C(C=C1)S(=O)(=O)N(CCC(=O)O)CC2=CC=CO2)OC
Isomeric SMILES
COC1=C(C=C(C=C1)S(=O)(=O)N(CCC(=O)O)CC2=CC=CO2)OC
InChI
InChI=1S/C16H19NO7S/c1-22-14-6-5-13(10-15(14)23-2)25(20,21)17(8-7-16(18)19)11-12-4-3-9-24-12/h3-6,9-10H,7-8,11H2,1-2H3,(H,18,19)
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