methyl (1R,5S)-6-ethoxycarbothioylsulfanyl-3-oxabicyclo[3.3.1]nonane-4-carboxylate

Systemtic Name: methyl (1R,5S)-6-ethoxycarbothioylsulfanyl-3-oxabicyclo[3.3.1]nonane-4-carboxylate Openeye Name: methyl (1R,5S)-6-ethoxycarbothioylsulfanyl-3-oxabicyclo[3.3.1]nonane-4-carboxylate CAS Name: (1R,5S)-6-[[ethoxy(sulfanylidene)methyl]thio]-3-oxabicyclo[3.3.1]nonane-4-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-6-ethoxycarbothioylsulfanyl-3-oxabicyclo[3.3.1]nonane-4-carboxylate Traditional Name: (1R,5S)-6-(ethoxycarbothioylthio)-3-oxabicyclo[3.3.1]nonane-4-carboxylic acid methyl ester Formula: C13H20O4S2 MolecularWeight: 304.4255

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC1CCC2CC1C(OC2)C(=O)OC

Isomeric SMILES

CCOC(=S)SC1CC[C@@H]2C[C@H]1C(OC2)C(=O)OC

InChI

InChI=1S/C13H20O4S2/c1-3-16-13(18)19-10-5-4-8-6-9(10)11(17-7-8)12(14)15-2/h8-11H,3-7H2,1-2H3/t8-,9-,10?,11?/m1/s1