3-(4-chloranyl-2-methoxy-phenyl)sulfanylpropanoic acid

Systemtic Name: 3-(4-chloranyl-2-methoxy-phenyl)sulfanylpropanoic acid Openeye Name: 3-(4-chloro-2-methoxy-phenyl)sulfanylpropanoic acid CAS Name: 3-[(4-chloro-2-methoxyphenyl)thio]propanoic acid IUPAC Name: 3-(4-chloro-2-methoxyphenyl)sulfanylpropanoic acid Traditional Name: 3-[(4-chloro-2-methoxy-phenyl)thio]propionic acid Formula: C10H11ClO3S MolecularWeight: 246.71054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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