tert-butyl N-[1-fluoranyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hept-6-yn-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-fluoranyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hept-6-yn-2-yl]carbamate Openeye Name: tert-butyl N-[4-(tert-butoxycarbonylamino)-1-ethynyl-5-fluoro-pentyl]carbamate CAS Name: N-[1-fluoro-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hept-6-yn-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-fluoro-5-[(2-methylpropan-2-yl)oxycarbonylamino]hept-6-yn-2-yl]carbamate Traditional Name: N-[1-[3-(tert-butoxycarbonylamino)-4-fluoro-butyl]prop-2-ynyl]carbamic acid tert-butyl ester Formula: C17H29FN2O4 MolecularWeight: 344.421563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(C#C)NC(=O)OC(C)(C)C)CF

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC(C#C)NC(=O)OC(C)(C)C)CF

InChI

InChI=1S/C17H29FN2O4/c1-8-12(19-14(21)23-16(2,3)4)9-10-13(11-18)20-15(22)24-17(5,6)7/h1,12-13H,9-11H2,2-7H3,(H,19,21)(H,20,22)