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2-[(6-methyl-8-sulfanyl-3,4-dihydro-2H-chromen-5-yl)oxy]ethanoic acid

2-[(6-methyl-8-sulfanyl-3,4-dihydro-2H-chromen-5-yl)oxy]ethanoic acid

Systemtic Name:2-[(6-methyl-8-sulfanyl-3,4-dihydro-2H-chromen-5-yl)oxy]ethanoic acid
Openeye Name:2-(6-methyl-8-sulfanyl-chroman-5-yl)oxyacetic acid
CAS Name:2-[(8-mercapto-6-methyl-3,4-dihydro-2H-1-benzopyran-5-yl)oxy]acetic acid
IUPAC Name:2-[(6-methyl-8-sulfanyl-3,4-dihydro-2H-chromen-5-yl)oxy]acetic acid
Traditional Name:2-(8-mercapto-6-methyl-chroman-5-yl)oxyacetic acid
Formula: C12H14O4S
MolecularWeight: 254.30216
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1OCC(=O)O)CCCO2)S


Isomeric SMILES

CC1=CC(=C2C(=C1OCC(=O)O)CCCO2)S


InChI

InChI=1S/C12H14O4S/c1-7-5-9(17)12-8(3-2-4-15-12)11(7)16-6-10(13)14/h5,17H,2-4,6H2,1H3,(H,13,14)


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