sodium 4-oxidanylidene-4-[(phenylmethyl)amino]butanoate

Systemtic Name: sodium 4-oxidanylidene-4-[(phenylmethyl)amino]butanoate Openeye Name: sodium 4-(benzylamino)-4-oxo-butanoate CAS Name: sodium 4-oxo-4-[(phenylmethyl)amino]butanoate IUPAC Name: sodium 4-(benzylamino)-4-oxobutanoate Traditional Name: sodium 4-(benzylamino)-4-keto-butyrate Formula: C11H12NNaO3 MolecularWeight: 229.20765

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3.Na/c13-10(6-7-11(14)15)12-8-9-4-2-1-3-5-9;/h1-5H,6-8H2,(H,12,13)(H,14,15);/q;+1/p-1