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

Systemtic Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-phenoxyphenoxy)pyrrolidine-2-carboxylate Openeye Name: (2S,4S)-1-tert-butoxycarbonyl-4-(4-phenoxyphenoxy)pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(4-phenoxyphenoxy)-2-pyrrolidinecarboxylate IUPAC Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-phenoxyphenoxy)pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-tert-butoxycarbonyl-4-(4-phenoxyphenoxy)pyrrolidine-2-carboxylate Formula: C22H24NO6- MolecularWeight: 398.42906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)[O-])OC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@H](C[C@H]1C(=O)[O-])OC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H25NO6/c1-22(2,3)29-21(26)23-14-18(13-19(23)20(24)25)28-17-11-9-16(10-12-17)27-15-7-5-4-6-8-15/h4-12,18-19H,13-14H2,1-3H3,(H,24,25)/p-1/t18-,19-/m0/s1