4-(4-oxidanyl-4-oxidanylidene-butanoyl)-2-phenylmethoxycarbonyl-piperazine-1-carboxylic acid

Systemtic Name: 4-(4-oxidanyl-4-oxidanylidene-butanoyl)-2-phenylmethoxycarbonyl-piperazine-1-carboxylic acid Openeye Name: 2-benzyloxycarbonyl-4-(4-hydroxy-4-oxo-butanoyl)piperazine-1-carboxylic acid CAS Name: 4-(4-hydroxy-1,4-dioxobutyl)-2-phenylmethoxycarbonyl-1-piperazinecarboxylic acid IUPAC Name: 4-(4-hydroxy-4-oxobutanoyl)-2-phenylmethoxycarbonylpiperazine-1-carboxylic acid Traditional Name: 2-carbobenzoxy-4-(4-hydroxy-4-keto-butanoyl)piperazine-1-carboxylic acid Formula: C17H20N2O7 MolecularWeight: 364.3499

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)CCC(=O)O)C(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CN(C(CN1C(=O)CCC(=O)O)C(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H20N2O7/c20-14(6-7-15(21)22)18-8-9-19(17(24)25)13(10-18)16(23)26-11-12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H,21,22)(H,24,25)