1-[methyl(oxidanyl)boranyl]-4-[(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)amino]pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[methyl(oxidanyl)boranyl]-4-[(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)amino]pyrrolidine-3-carboxylic acid Openeye Name: 4-[(2-benzyloxy-1-methyl-2-oxo-ethyl)amino]-1-[hydroxy(methyl)boranyl]pyrrolidine-3-carboxylic acid CAS Name: 1-[hydroxy(methyl)boranyl]-4-[(1-oxo-1-phenylmethoxypropan-2-yl)amino]-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[hydroxy(methyl)boranyl]-4-[(1-oxo-1-phenylmethoxypropan-2-yl)amino]pyrrolidine-3-carboxylic acid Traditional Name: 4-[(2-benzoxy-2-keto-1-methyl-ethyl)amino]-1-[hydroxy(methyl)boranyl]pyrrolidine-3-carboxylic acid Formula: C16H23BN2O5 MolecularWeight: 334.17522

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1CC(C(C1)NC(C)C(=O)OCC2=CC=CC=C2)C(=O)O)O

Isomeric SMILES

B(C)(N1CC(C(C1)NC(C)C(=O)OCC2=CC=CC=C2)C(=O)O)O

InChI

InChI=1S/C16H23BN2O5/c1-11(16(22)24-10-12-6-4-3-5-7-12)18-14-9-19(17(2)23)8-13(14)15(20)21/h3-7,11,13-14,18,23H,8-10H2,1-2H3,(H,20,21)