3-(3-fluoranylpyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylmethoxy-propanoic acid

Systemtic Name: 3-(3-fluoranylpyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylmethoxy-propanoic acid Openeye Name: 2-benzyloxy-3-(tert-butoxycarbonylamino)-3-(3-fluoro-2-pyridyl)propanoic acid CAS Name: 3-(3-fluoro-2-pyridinyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenylmethoxypropanoic acid IUPAC Name: 3-(3-fluoropyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylmethoxypropanoic acid Traditional Name: 2-benzoxy-3-(tert-butoxycarbonylamino)-3-(3-fluoro-2-pyridyl)propionic acid Formula: C20H23FN2O5 MolecularWeight: 390.405423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=C(C=CC=N1)F)C(C(=O)O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1=C(C=CC=N1)F)C(C(=O)O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23FN2O5/c1-20(2,3)28-19(26)23-16(15-14(21)10-7-11-22-15)17(18(24)25)27-12-13-8-5-4-6-9-13/h4-11,16-17H,12H2,1-3H3,(H,23,26)(H,24,25)