4-(5-fluoranyl-2-phenylmethoxy-phenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

Systemtic Name: 4-(5-fluoranyl-2-phenylmethoxy-phenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Openeye Name: 4-(2-benzyloxy-5-fluoro-phenyl)-3-(tert-butoxycarbonylamino)butanoic acid CAS Name: 4-(5-fluoro-2-phenylmethoxyphenyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid IUPAC Name: 4-(5-fluoro-2-phenylmethoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Traditional Name: 4-(2-benzoxy-5-fluoro-phenyl)-3-(tert-butoxycarbonylamino)butyric acid Formula: C22H26FNO5 MolecularWeight: 403.443943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(C=CC(=C1)F)OCC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=C(C=CC(=C1)F)OCC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C22H26FNO5/c1-22(2,3)29-21(27)24-18(13-20(25)26)12-16-11-17(23)9-10-19(16)28-14-15-7-5-4-6-8-15/h4-11,18H,12-14H2,1-3H3,(H,24,27)(H,25,26)