dimethyl 2-[(4-fluoranyl-3-nitro-phenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate

Systemtic Name: dimethyl 2-[(4-fluoranyl-3-nitro-phenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate Openeye Name: dimethyl 2-(tert-butoxycarbonylamino)-4-[(4-fluoranyl-3-nitro-phenyl)methyl]pentanedioate CAS Name: 2-[(4-fluoranyl-3-nitrophenyl)methyl]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(4-fluoranyl-3-nitrophenyl)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate Traditional Name: 2-(tert-butoxycarbonylamino)-4-(4-fluoranyl-3-nitro-benzyl)glutaric acid dimethyl ester Formula: C19H25FN2O8 MolecularWeight: 427.411338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(CC1=CC(=C(C=C1)F)[N+](=O)[O-])C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(CC1=CC(=C(C=C1)[18F])[N+](=O)[O-])C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H25FN2O8/c1-19(2,3)30-18(25)21-14(17(24)29-5)10-12(16(23)28-4)8-11-6-7-13(20)15(9-11)22(26)27/h6-7,9,12,14H,8,10H2,1-5H3,(H,21,25)/i20-1