sodium (2S)-3-(4-hydroxyphenyl)-2-methoxy-propanoate

Systemtic Name: sodium (2S)-3-(4-hydroxyphenyl)-2-methoxy-propanoate Openeye Name: sodium (2S)-3-(4-hydroxyphenyl)-2-methoxy-propanoate CAS Name: sodium (2S)-3-(4-hydroxyphenyl)-2-methoxypropanoate IUPAC Name: sodium (2S)-3-(4-hydroxyphenyl)-2-methoxypropanoate Traditional Name: sodium (2S)-3-(4-hydroxyphenyl)-2-methoxy-propionate Formula: C10H11NaO4 MolecularWeight: 218.18171

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC=C(C=C1)O)C(=O)[O-].[Na+]

Isomeric SMILES

CO[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C10H12O4.Na/c1-14-9(10(12)13)6-7-2-4-8(11)5-3-7;/h2-5,9,11H,6H2,1H3,(H,12,13);/q;+1/p-1/t9-;/m0./s1