(2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-nitrophenoxy)pyrrolidine-2-carboxylate

Systemtic Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-nitrophenoxy)pyrrolidine-2-carboxylate Openeye Name: (2S,4S)-1-tert-butoxycarbonyl-4-(4-nitrophenoxy)pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(4-nitrophenoxy)-2-pyrrolidinecarboxylate IUPAC Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-nitrophenoxy)pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-tert-butoxycarbonyl-4-(4-nitrophenoxy)pyrrolidine-2-carboxylate Formula: C16H19N2O7- MolecularWeight: 351.33126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)[O-])OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@H](C[C@H]1C(=O)[O-])OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O7/c1-16(2,3)25-15(21)17-9-12(8-13(17)14(19)20)24-11-6-4-10(5-7-11)18(22)23/h4-7,12-13H,8-9H2,1-3H3,(H,19,20)/p-1/t12-,13-/m0/s1