2,5-bis(azanyl)-5-oxidanylidene-pentanoic acid; 2-phenylethanoate

Systemtic Name: 2,5-bis(azanyl)-5-oxidanylidene-pentanoic acid; 2-phenylethanoate Openeye Name: 2,5-diamino-5-oxo-pentanoic acid; 2-phenylacetate CAS Name: 2,5-diamino-5-oxopentanoic acid; 2-phenylacetate IUPAC Name: 2,5-diamino-5-oxopentanoic acid; 2-phenylacetate Traditional Name: 2,5-diamino-5-keto-valeric acid; 2-phenylacetate Formula: C13H17N2O5- MolecularWeight: 281.28448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)[O-].C(CC(=O)N)C(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)[O-].C(CC(=O)N)C(C(=O)O)N

InChI

InChI=1S/C8H8O2.C5H10N2O3/c9-8(10)6-7-4-2-1-3-5-7;6-3(5(9)10)1-2-4(7)8/h1-5H,6H2,(H,9,10);3H,1-2,6H2,(H2,7,8)(H,9,10)/p-1