sodium (2R)-2-(3-azanyl-3-oxidanylidene-propyl)-4-oxidanylidene-5-phenyl-pentanoate

Systemtic Name: sodium (2R)-2-(3-azanyl-3-oxidanylidene-propyl)-4-oxidanylidene-5-phenyl-pentanoate Openeye Name: sodium (2R)-2-(3-amino-3-oxo-propyl)-4-oxo-5-phenyl-pentanoate CAS Name: sodium (2R)-2-(3-amino-3-oxopropyl)-4-oxo-5-phenylpentanoate IUPAC Name: sodium (2R)-2-(3-amino-3-oxopropyl)-4-oxo-5-phenylpentanoate Traditional Name: sodium (2R)-2-(3-amino-3-keto-propyl)-4-keto-5-phenyl-valerate Formula: C14H16NNaO4 MolecularWeight: 285.27091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)C[C@@H](CCC(=O)N)C(=O)[O-].[Na+]

InChI

InChI=1S/C14H17NO4.Na/c15-13(17)7-6-11(14(18)19)9-12(16)8-10-4-2-1-3-5-10;/h1-5,11H,6-9H2,(H2,15,17)(H,18,19);/q;+1/p-1/t11-;/m1./s1