3-(2-chloranyl-5-methoxy-phenyl)sulfanylpropanoic acid

Systemtic Name: 3-(2-chloranyl-5-methoxy-phenyl)sulfanylpropanoic acid Openeye Name: 3-(2-chloro-5-methoxy-phenyl)sulfanylpropanoic acid CAS Name: 3-[(2-chloro-5-methoxyphenyl)thio]propanoic acid IUPAC Name: 3-(2-chloro-5-methoxyphenyl)sulfanylpropanoic acid Traditional Name: 3-[(2-chloro-5-methoxy-phenyl)thio]propionic acid Formula: C10H11ClO3S MolecularWeight: 246.71054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)SCCC(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)SCCC(=O)O

InChI

InChI=1S/C10H11ClO3S/c1-14-7-2-3-8(11)9(6-7)15-5-4-10(12)13/h2-3,6H,4-5H2,1H3,(H,12,13)