3-(2-fluoranyl-4,5-dimethoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-(2-fluoranyl-4,5-dimethoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-(2-fluoro-4,5-dimethoxy-phenyl)propanoic acid CAS Name: 3-(2-fluoro-4,5-dimethoxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(2-fluoro-4,5-dimethoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-(2-fluoro-4,5-dimethoxy-phenyl)propionic acid Formula: C16H22FNO6 MolecularWeight: 343.347383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC(=C(C=C1F)OC)OC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC(=C(C=C1F)OC)OC)C(=O)O

InChI

InChI=1S/C16H22FNO6/c1-16(2,3)24-15(21)18-11(14(19)20)6-9-7-12(22-4)13(23-5)8-10(9)17/h7-8,11H,6H2,1-5H3,(H,18,21)(H,19,20)