4-[[(2R)-butan-2-yl]sulfanylmethyl]-5-methyl-furan-2-carboxylate

Systemtic Name: 4-[[(2R)-butan-2-yl]sulfanylmethyl]-5-methyl-furan-2-carboxylate Openeye Name: 5-methyl-4-[[(1R)-1-methylpropyl]sulfanylmethyl]furan-2-carboxylate CAS Name: 4-[[[(2R)-butan-2-yl]thio]methyl]-5-methyl-2-furancarboxylate IUPAC Name: 4-[[(2R)-butan-2-yl]sulfanylmethyl]-5-methylfuran-2-carboxylate Traditional Name: 5-methyl-4-[[[(1R)-1-methylpropyl]thio]methyl]-2-furoate Formula: C11H15O3S- MolecularWeight: 227.3

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC1=C(OC(=C1)C(=O)[O-])C

Isomeric SMILES

CC[C@@H](C)SCC1=C(OC(=C1)C(=O)[O-])C

InChI

InChI=1S/C11H16O3S/c1-4-7(2)15-6-9-5-10(11(12)13)14-8(9)3/h5,7H,4,6H2,1-3H3,(H,12,13)/p-1/t7-/m1/s1