[6-(hydroxymethyl)-1,2-dithiin-3-yl]methyl cyclopentanecarboxylate

Systemtic Name: [6-(hydroxymethyl)-1,2-dithiin-3-yl]methyl cyclopentanecarboxylate Openeye Name: [6-(hydroxymethyl)dithiin-3-yl]methyl cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [6-(hydroxymethyl)-3-dithiinyl]methyl ester IUPAC Name: [6-(hydroxymethyl)dithiin-3-yl]methyl cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid (6-methyloldithiin-3-yl)methyl ester Formula: C12H16O3S2 MolecularWeight: 272.38364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)OCC2=CC=C(SS2)CO

Isomeric SMILES

C1CCC(C1)C(=O)OCC2=CC=C(SS2)CO

InChI

InChI=1S/C12H16O3S2/c13-7-10-5-6-11(17-16-10)8-15-12(14)9-3-1-2-4-9/h5-6,9,13H,1-4,7-8H2