3-[[2-chloranyl-3,6-bis(fluoranyl)phenyl]methoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-[[2-chloranyl-3,6-bis(fluoranyl)phenyl]methoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[(2-chloro-3,6-difluoro-phenyl)methoxy]propanoic acid CAS Name: 3-[(2-chloro-3,6-difluorophenyl)methoxy]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(2-chloro-3,6-difluorophenyl)methoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-(2-chloro-3,6-difluoro-benzyl)oxy-propionic acid Formula: C15H18ClF2NO5 MolecularWeight: 365.756926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COCC1=C(C=CC(=C1Cl)F)F)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(COCC1=C(C=CC(=C1Cl)F)F)C(=O)O

InChI

InChI=1S/C15H18ClF2NO5/c1-15(2,3)24-14(22)19-11(13(20)21)7-23-6-8-9(17)4-5-10(18)12(8)16/h4-5,11H,6-7H2,1-3H3,(H,19,22)(H,20,21)