2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl-[2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]ethanoyl]amino]ethanoic acid

Systemtic Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl-[2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]ethanoyl]amino]ethanoic acid Openeye Name: 2-[2-(tert-butoxycarbonylamino)ethyl-[2-(2,3,4,5,6-pentafluorophenyl)acetyl]amino]acetic acid CAS Name: 2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl-[1-oxo-2-(2,3,4,5,6-pentafluorophenyl)ethyl]amino]acetic acid IUPAC Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl-[2-(2,3,4,5,6-pentafluorophenyl)acetyl]amino]acetic acid Traditional Name: 2-[2-(tert-butoxycarbonylamino)ethyl-[2-(2,3,4,5,6-pentafluorophenyl)acetyl]amino]acetic acid Formula: C17H19F5N2O5 MolecularWeight: 426.335176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN(CC(=O)O)C(=O)CC1=C(C(=C(C(=C1F)F)F)F)F

Isomeric SMILES

CC(C)(C)OC(=O)NCCN(CC(=O)O)C(=O)CC1=C(C(=C(C(=C1F)F)F)F)F

InChI

InChI=1S/C17H19F5N2O5/c1-17(2,3)29-16(28)23-4-5-24(7-10(26)27)9(25)6-8-11(18)13(20)15(22)14(21)12(8)19/h4-7H2,1-3H3,(H,23,28)(H,26,27)