(2S,4S)-4-(4-ethyl-2-methoxy-phenoxy)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S,4S)-4-(4-ethyl-2-methoxy-phenoxy)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate Openeye Name: (2S,4S)-1-tert-butoxycarbonyl-4-(4-ethyl-2-methoxy-phenoxy)pyrrolidine-2-carboxylate CAS Name: (2S,4S)-4-(4-ethyl-2-methoxyphenoxy)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S,4S)-4-(4-ethyl-2-methoxyphenoxy)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-tert-butoxycarbonyl-4-(4-ethyl-2-methoxy-phenoxy)pyrrolidine-2-carboxylate Formula: C19H26NO6- MolecularWeight: 364.41284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC2CC(N(C2)C(=O)OC(C)(C)C)C(=O)[O-])OC

Isomeric SMILES

CCC1=CC(=C(C=C1)O[C@H]2C[C@H](N(C2)C(=O)OC(C)(C)C)C(=O)[O-])OC

InChI

InChI=1S/C19H27NO6/c1-6-12-7-8-15(16(9-12)24-5)25-13-10-14(17(21)22)20(11-13)18(23)26-19(2,3)4/h7-9,13-14H,6,10-11H2,1-5H3,(H,21,22)/p-1/t13-,14-/m0/s1