4-[(2-methoxyphenyl)sulfanylmethyl]-5-methyl-furan-2-carboxylate

Systemtic Name: 4-[(2-methoxyphenyl)sulfanylmethyl]-5-methyl-furan-2-carboxylate Openeye Name: 4-[(2-methoxyphenyl)sulfanylmethyl]-5-methyl-furan-2-carboxylate CAS Name: 4-[[(2-methoxyphenyl)thio]methyl]-5-methyl-2-furancarboxylate IUPAC Name: 4-[(2-methoxyphenyl)sulfanylmethyl]-5-methylfuran-2-carboxylate Traditional Name: 4-[[(2-methoxyphenyl)thio]methyl]-5-methyl-2-furoate Formula: C14H13O4S- MolecularWeight: 277.31562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)[O-])CSC2=CC=CC=C2OC

Isomeric SMILES

CC1=C(C=C(O1)C(=O)[O-])CSC2=CC=CC=C2OC

InChI

InChI=1S/C14H14O4S/c1-9-10(7-12(18-9)14(15)16)8-19-13-6-4-3-5-11(13)17-2/h3-7H,8H2,1-2H3,(H,15,16)/p-1