methyl (2R,3S)-2,3-bis(1-oxidanylcyclohexyl)-2,3-dihydrothiophene-5-carboxylate

Systemtic Name: methyl (2R,3S)-2,3-bis(1-oxidanylcyclohexyl)-2,3-dihydrothiophene-5-carboxylate Openeye Name: methyl (2R,3S)-2,3-bis(1-hydroxycyclohexyl)-2,3-dihydrothiophene-5-carboxylate CAS Name: (2R,3S)-2,3-bis(1-hydroxycyclohexyl)-2,3-dihydrothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl (2R,3S)-2,3-bis(1-hydroxycyclohexyl)-2,3-dihydrothiophene-5-carboxylate Traditional Name: (2R,3S)-2,3-bis(1-hydroxycyclohexyl)-2,3-dihydrothiophene-5-carboxylic acid methyl ester Formula: C18H28O4S MolecularWeight: 340.47752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(C(S1)C2(CCCCC2)O)C3(CCCCC3)O

Isomeric SMILES

COC(=O)C1=C[C@H]([C@@H](S1)C2(CCCCC2)O)C3(CCCCC3)O

InChI

InChI=1S/C18H28O4S/c1-22-16(19)14-12-13(17(20)8-4-2-5-9-17)15(23-14)18(21)10-6-3-7-11-18/h12-13,15,20-21H,2-11H2,1H3/t13-,15-/m1/s1