methyl 2-[2-(2-methoxyphenyl)sulfanylcyclohexyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-(2-methoxyphenyl)sulfanylcyclohexyl]sulfanylethanoate Openeye Name: methyl 2-[2-(2-methoxyphenyl)sulfanylcyclohexyl]sulfanylacetate CAS Name: 2-[[2-[(2-methoxyphenyl)thio]cyclohexyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-methoxyphenyl)sulfanylcyclohexyl]sulfanylacetate Traditional Name: 2-[[2-[(2-methoxyphenyl)thio]cyclohexyl]thio]acetic acid methyl ester Formula: C16H22O3S2 MolecularWeight: 326.47408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1SC2CCCCC2SCC(=O)OC

Isomeric SMILES

COC1=CC=CC=C1SC2CCCCC2SCC(=O)OC

InChI

InChI=1S/C16H22O3S2/c1-18-12-7-3-4-8-13(12)21-15-10-6-5-9-14(15)20-11-16(17)19-2/h3-4,7-8,14-15H,5-6,9-11H2,1-2H3