(1R,2R,3S)-2-(1,3-dithiolan-2-yl)-3-ethoxycarbonyl-cyclopentane-1-carboxylic acid

Systemtic Name: (1R,2R,3S)-2-(1,3-dithiolan-2-yl)-3-ethoxycarbonyl-cyclopentane-1-carboxylic acid Openeye Name: (1R,2R,3S)-2-(1,3-dithiolan-2-yl)-3-ethoxycarbonyl-cyclopentanecarboxylic acid CAS Name: (1R,2R,3S)-2-(1,3-dithiolan-2-yl)-3-ethoxycarbonyl-1-cyclopentanecarboxylic acid IUPAC Name: (1R,2R,3S)-2-(1,3-dithiolan-2-yl)-3-ethoxycarbonylcyclopentane-1-carboxylic acid Traditional Name: (1R,2R,3S)-3-carbethoxy-2-(1,3-dithiolan-2-yl)cyclopentanecarboxylic acid Formula: C12H18O4S2 MolecularWeight: 290.39892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(C1C2SCCS2)C(=O)O

Isomeric SMILES

CCOC(=O)[C@H]1CC[C@H]([C@H]1C2SCCS2)C(=O)O

InChI

InChI=1S/C12H18O4S2/c1-2-16-11(15)8-4-3-7(10(13)14)9(8)12-17-5-6-18-12/h7-9,12H,2-6H2,1H3,(H,13,14)/t7-,8+,9-/m1/s1