1-(2-azanyl-3-methyl-butanoyl)-2-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-azanyl-3-methyl-butanoyl)-2-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-amino-3-methyl-butanoyl)-4-benzyloxy-2-tert-butoxycarbonyl-pyrrolidine-2-carboxylic acid CAS Name: 1-(2-amino-3-methyl-1-oxobutyl)-2-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylmethoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-amino-3-methylbutanoyl)-2-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxypyrrolidine-2-carboxylic acid Traditional Name: 1-(2-amino-3-methyl-butanoyl)-4-benzoxy-2-tert-butoxycarbonyl-proline Formula: C22H32N2O6 MolecularWeight: 420.49928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC(CC1(C(=O)O)C(=O)OC(C)(C)C)OCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C(C(=O)N1CC(CC1(C(=O)O)C(=O)OC(C)(C)C)OCC2=CC=CC=C2)N

InChI

InChI=1S/C22H32N2O6/c1-14(2)17(23)18(25)24-12-16(29-13-15-9-7-6-8-10-15)11-22(24,19(26)27)20(28)30-21(3,4)5/h6-10,14,16-17H,11-13,23H2,1-5H3,(H,26,27)