2-[4-[(4-chloranylphenoxy)methyl]phenoxy]propanethioic S-acid

Systemtic Name: 2-[4-[(4-chloranylphenoxy)methyl]phenoxy]propanethioic S-acid Openeye Name: 2-[4-[(4-chlorophenoxy)methyl]phenoxy]propanethioic S-acid CAS Name: 2-[4-[(4-chlorophenoxy)methyl]phenoxy]propanethioic S-acid IUPAC Name: 2-[4-[(4-chlorophenoxy)methyl]phenoxy]propanethioic S-acid Traditional Name: 2-[4-[(4-chlorophenoxy)methyl]phenoxy]thiopropionic acid Formula: C16H15ClO3S MolecularWeight: 322.8065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)S)OC1=CC=C(C=C1)COC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)S)OC1=CC=C(C=C1)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H15ClO3S/c1-11(16(18)21)20-15-6-2-12(3-7-15)10-19-14-8-4-13(17)5-9-14/h2-9,11H,10H2,1H3,(H,18,21)