(2S)-2-[2,3-bis(oxidanylidene)-4-phenylmethoxycarbonyl-piperazin-1-yl]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[2,3-bis(oxidanylidene)-4-phenylmethoxycarbonyl-piperazin-1-yl]-3-methyl-butanoic acid Openeye Name: (2S)-2-(4-benzyloxycarbonyl-2,3-dioxo-piperazin-1-yl)-3-methyl-butanoic acid CAS Name: (2S)-2-(2,3-dioxo-4-phenylmethoxycarbonyl-1-piperazinyl)-3-methylbutanoic acid IUPAC Name: (2S)-2-(2,3-dioxo-4-phenylmethoxycarbonylpiperazin-1-yl)-3-methylbutanoic acid Traditional Name: (2S)-2-(4-carbobenzoxy-2,3-diketo-piperazino)-3-methyl-butyric acid Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1CCN(C(=O)C1=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)N1CCN(C(=O)C1=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O6/c1-11(2)13(16(22)23)18-8-9-19(15(21)14(18)20)17(24)25-10-12-6-4-3-5-7-12/h3-7,11,13H,8-10H2,1-2H3,(H,22,23)/t13-/m0/s1