O2-methyl O1-(phenylmethyl) (2S,3R)-5-oxidanylidene-3-propan-2-yl-piperazine-1,2-dicarboxylate

Systemtic Name: O2-methyl O1-(phenylmethyl) (2S,3R)-5-oxidanylidene-3-propan-2-yl-piperazine-1,2-dicarboxylate Openeye Name: O1-benzyl O2-methyl (2S,3R)-3-isopropyl-5-oxo-piperazine-1,2-dicarboxylate CAS Name: (2S,3R)-5-oxo-3-propan-2-ylpiperazine-1,2-dicarboxylic acid O2-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-methyl (2S,3R)-5-oxo-3-propan-2-ylpiperazine-1,2-dicarboxylate Traditional Name: (2S,3R)-3-isopropyl-5-keto-piperazine-1,2-dicarboxylic acid O1-benzyl ester O2-methyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(N(CC(=O)N1)C(=O)OCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)[C@@H]1[C@H](N(CC(=O)N1)C(=O)OCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H22N2O5/c1-11(2)14-15(16(21)23-3)19(9-13(20)18-14)17(22)24-10-12-7-5-4-6-8-12/h4-8,11,14-15H,9-10H2,1-3H3,(H,18,20)/t14-,15+/m1/s1