methyl 2-(2,8-dimethyl-6-sulfanyl-3,4-dihydrochromen-2-yl)ethanoate

Systemtic Name: methyl 2-(2,8-dimethyl-6-sulfanyl-3,4-dihydrochromen-2-yl)ethanoate Openeye Name: methyl 2-(2,8-dimethyl-6-sulfanyl-chroman-2-yl)acetate CAS Name: 2-(6-mercapto-2,8-dimethyl-3,4-dihydro-2H-1-benzopyran-2-yl)acetic acid methyl ester IUPAC Name: methyl 2-(2,8-dimethyl-6-sulfanyl-3,4-dihydrochromen-2-yl)acetate Traditional Name: 2-(6-mercapto-2,8-dimethyl-chroman-2-yl)acetic acid methyl ester Formula: C14H18O3S MolecularWeight: 266.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S)CCC(O2)(C)CC(=O)OC

Isomeric SMILES

CC1=C2C(=CC(=C1)S)CCC(O2)(C)CC(=O)OC

InChI

InChI=1S/C14H18O3S/c1-9-6-11(18)7-10-4-5-14(2,17-13(9)10)8-12(15)16-3/h6-7,18H,4-5,8H2,1-3H3