methyl (2S)-2-fluoranyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-fluoranyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-benzyl-3-(tert-butoxycarbonylamino)-2-fluoro-propanoate CAS Name: (2S)-2-fluoro-2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-benzyl-2-fluoro-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-benzyl-3-(tert-butoxycarbonylamino)-2-fluoro-propionic acid methyl ester Formula: C16H22FNO4 MolecularWeight: 311.348583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(CC1=CC=CC=C1)(C(=O)OC)F

Isomeric SMILES

CC(C)(C)OC(=O)NC[C@@](CC1=CC=CC=C1)(C(=O)OC)F

InChI

InChI=1S/C16H22FNO4/c1-15(2,3)22-14(20)18-11-16(17,13(19)21-4)10-12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3,(H,18,20)/t16-/m0/s1