(2S,4S)-4-(2-methoxy-4-methyl-phenoxy)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-(2-methoxy-4-methyl-phenoxy)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-1-tert-butoxycarbonyl-4-(2-methoxy-4-methyl-phenoxy)pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-4-(2-methoxy-4-methylphenoxy)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-(2-methoxy-4-methylphenoxy)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-tert-butoxycarbonyl-4-(2-methoxy-4-methyl-phenoxy)proline Formula: C18H25NO6 MolecularWeight: 351.3942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2CC(N(C2)C(=O)OC(C)(C)C)C(=O)O)OC

Isomeric SMILES

CC1=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/C18H25NO6/c1-11-6-7-14(15(8-11)23-5)24-12-9-13(16(20)21)19(10-12)17(22)25-18(2,3)4/h6-8,12-13H,9-10H2,1-5H3,(H,20,21)/t12-,13-/m0/s1