(2S)-2-azanyl-5-ethoxy-5-oxidanylidene-pentanoic acid; (2S)-2-azanylpentanedioic acid

Systemtic Name: (2S)-2-azanyl-5-ethoxy-5-oxidanylidene-pentanoic acid; (2S)-2-azanylpentanedioic acid Openeye Name: (2S)-2-amino-5-ethoxy-5-oxo-pentanoic acid; (2S)-2-aminopentanedioic acid CAS Name: (2S)-2-amino-5-ethoxy-5-oxopentanoic acid; (2S)-2-aminopentanedioic acid IUPAC Name: (2S)-2-amino-5-ethoxy-5-oxopentanoic acid; (2S)-2-aminopentanedioic acid Traditional Name: (2S)-2-amino-5-ethoxy-5-keto-valeric acid; (2S)-2-aminoglutaric acid Formula: C12H22N2O8 MolecularWeight: 322.31168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)O)N.C(CC(=O)O)C(C(=O)O)N

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)O)N.C(CC(=O)O)[C@@H](C(=O)O)N

InChI

InChI=1S/C7H13NO4.C5H9NO4/c1-2-12-6(9)4-3-5(8)7(10)11;6-3(5(9)10)1-2-4(7)8/h5H,2-4,8H2,1H3,(H,10,11);3H,1-2,6H2,(H,7,8)(H,9,10)/t5-;3-/m00/s1