methyl 2-[(5-chloranyl-2-oxidanyl-phenyl)-phenyl-methyl]sulfanylethanoate

Systemtic Name: methyl 2-[(5-chloranyl-2-oxidanyl-phenyl)-phenyl-methyl]sulfanylethanoate Openeye Name: methyl 2-[(5-chloro-2-hydroxy-phenyl)-phenyl-methyl]sulfanylacetate CAS Name: 2-[[(5-chloro-2-hydroxyphenyl)-phenylmethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-2-hydroxyphenyl)-phenylmethyl]sulfanylacetate Traditional Name: 2-[[(5-chloro-2-hydroxy-phenyl)-phenyl-methyl]thio]acetic acid methyl ester Formula: C16H15ClO3S MolecularWeight: 322.8065

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC(C1=CC=CC=C1)C2=C(C=CC(=C2)Cl)O

Isomeric SMILES

COC(=O)CSC(C1=CC=CC=C1)C2=C(C=CC(=C2)Cl)O

InChI

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