3-(4-ethoxycarbonyl-2,5-dimethyl-phenyl)sulfanylpropanoic acid

Systemtic Name: 3-(4-ethoxycarbonyl-2,5-dimethyl-phenyl)sulfanylpropanoic acid Openeye Name: 3-(4-ethoxycarbonyl-2,5-dimethyl-phenyl)sulfanylpropanoic acid CAS Name: 3-[(4-ethoxycarbonyl-2,5-dimethylphenyl)thio]propanoic acid IUPAC Name: 3-(4-ethoxycarbonyl-2,5-dimethylphenyl)sulfanylpropanoic acid Traditional Name: 3-[(4-carbethoxy-2,5-dimethyl-phenyl)thio]propionic acid Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1C)SCCC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1C)SCCC(=O)O)C

InChI

InChI=1S/C14H18O4S/c1-4-18-14(17)11-7-10(3)12(8-9(11)2)19-6-5-13(15)16/h7-8H,4-6H2,1-3H3,(H,15,16)