tert-butyl (2R,3R)-3-(4-fluorophenyl)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitro-propanoate

Systemtic Name: tert-butyl (2R,3R)-3-(4-fluorophenyl)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitro-propanoate Openeye Name: tert-butyl (2R,3R)-3-(tert-butoxycarbonylamino)-3-(4-fluorophenyl)-2-methyl-2-nitro-propanoate CAS Name: (2R,3R)-3-(4-fluorophenyl)-2-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-nitropropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3R)-3-(4-fluorophenyl)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitropropanoate Traditional Name: (2R,3R)-3-(tert-butoxycarbonylamino)-3-(4-fluorophenyl)-2-methyl-2-nitro-propionic acid tert-butyl ester Formula: C19H27FN2O6 MolecularWeight: 398.425883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27FN2O6/c1-17(2,3)27-15(23)19(7,22(25)26)14(12-8-10-13(20)11-9-12)21-16(24)28-18(4,5)6/h8-11,14H,1-7H3,(H,21,24)/t14-,19-/m1/s1