sodium (2S)-2-(4-hydroxyphenyl)-2-(2-phenylethanoylamino)ethanoate

Systemtic Name: sodium (2S)-2-(4-hydroxyphenyl)-2-(2-phenylethanoylamino)ethanoate Openeye Name: sodium (2S)-2-(4-hydroxyphenyl)-2-[(2-phenylacetyl)amino]acetate CAS Name: sodium (2S)-2-(4-hydroxyphenyl)-2-[(1-oxo-2-phenylethyl)amino]acetate IUPAC Name: sodium (2S)-2-(4-hydroxyphenyl)-2-[(2-phenylacetyl)amino]acetate Traditional Name: sodium (2S)-2-(4-hydroxyphenyl)-2-[(2-phenylacetyl)amino]acetate Formula: C16H14NNaO4 MolecularWeight: 307.27643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(C2=CC=C(C=C2)O)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)N[C@@H](C2=CC=C(C=C2)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C16H15NO4.Na/c18-13-8-6-12(7-9-13)15(16(20)21)17-14(19)10-11-4-2-1-3-5-11;/h1-9,15,18H,10H2,(H,17,19)(H,20,21);/q;+1/p-1/t15-;/m0./s1