methyl 2-[(2S,6S)-6-methylthian-2-yl]ethanoate

Systemtic Name: methyl 2-[(2S,6S)-6-methylthian-2-yl]ethanoate Openeye Name: methyl 2-[(2S,6S)-6-methyltetrahydrothiopyran-2-yl]acetate CAS Name: 2-[(2S,6S)-6-methyl-2-thianyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S,6S)-6-methylthian-2-yl]acetate Traditional Name: 2-[(2S,6S)-6-methyltetrahydrothiopyran-2-yl]acetic acid methyl ester Formula: C9H16O2S MolecularWeight: 188.28714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(S1)CC(=O)OC

Isomeric SMILES

C[C@H]1CCC[C@H](S1)CC(=O)OC

InChI

InChI=1S/C9H16O2S/c1-7-4-3-5-8(12-7)6-9(10)11-2/h7-8H,3-6H2,1-2H3/t7-,8-/m0/s1