(2R)-2-[(4-ethoxyphenyl)methylsulfanyl]butanedioate

Systemtic Name: (2R)-2-[(4-ethoxyphenyl)methylsulfanyl]butanedioate Openeye Name: (2R)-2-[(4-ethoxyphenyl)methylsulfanyl]butanedioate CAS Name: (2R)-2-[(4-ethoxyphenyl)methylthio]butanedioate IUPAC Name: (2R)-2-[(4-ethoxyphenyl)methylsulfanyl]butanedioate Traditional Name: (2R)-2-[(4-ethoxybenzyl)thio]succinate Formula: C13H14O5S-2 MolecularWeight: 282.31226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CSC(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)CS[C@H](CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H16O5S/c1-2-18-10-5-3-9(4-6-10)8-19-11(13(16)17)7-12(14)15/h3-6,11H,2,7-8H2,1H3,(H,14,15)(H,16,17)/p-2/t11-/m1/s1