3-oxidanylpropyl 2-(3-ethoxy-4-oxidanyl-phenyl)sulfanylethanoate

Systemtic Name: 3-oxidanylpropyl 2-(3-ethoxy-4-oxidanyl-phenyl)sulfanylethanoate Openeye Name: 3-hydroxypropyl 2-(3-ethoxy-4-hydroxy-phenyl)sulfanylacetate CAS Name: 2-[(3-ethoxy-4-hydroxyphenyl)thio]acetic acid 3-hydroxypropyl ester IUPAC Name: 3-hydroxypropyl 2-(3-ethoxy-4-hydroxyphenyl)sulfanylacetate Traditional Name: 2-[(3-ethoxy-4-hydroxy-phenyl)thio]acetic acid 3-hydroxypropyl ester Formula: C13H18O5S MolecularWeight: 286.34402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)SCC(=O)OCCCO)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)SCC(=O)OCCCO)O

InChI

InChI=1S/C13H18O5S/c1-2-17-12-8-10(4-5-11(12)15)19-9-13(16)18-7-3-6-14/h4-5,8,14-15H,2-3,6-7,9H2,1H3