methyl 5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-methyl-furan-3-carboxylate CAS Name: 5-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-methylfuran-3-carboxylate Traditional Name: 5-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C16H16O5S MolecularWeight: 320.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=CC3=C(C=C2)OCCO3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=CC3=C(C=C2)OCCO3)C(=O)OC

InChI

InChI=1S/C16H16O5S/c1-10-13(16(17)18-2)7-11(21-10)9-22-12-3-4-14-15(8-12)20-6-5-19-14/h3-4,7-8H,5-6,9H2,1-2H3