2-[[4-oxidanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]pentanedioic acid

Systemtic Name: 2-[[4-oxidanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]pentanedioic acid Openeye Name: 2-[[2-(benzyloxycarbonylamino)-4-hydroxy-4-oxo-butanoyl]amino]pentanedioic acid CAS Name: 2-[[4-hydroxy-1,4-dioxo-2-(phenylmethoxycarbonylamino)butyl]amino]pentanedioic acid IUPAC Name: 2-[[4-hydroxy-4-oxo-2-(phenylmethoxycarbonylamino)butanoyl]amino]pentanedioic acid Traditional Name: 2-[[2-(benzyloxycarbonylamino)-4-hydroxy-4-keto-butanoyl]amino]glutaric acid Formula: C17H20N2O9 MolecularWeight: 396.3487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C17H20N2O9/c20-13(21)7-6-11(16(25)26)18-15(24)12(8-14(22)23)19-17(27)28-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H,18,24)(H,19,27)(H,20,21)(H,22,23)(H,25,26)