5-[(3-methoxyphenyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(3-methoxyphenyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(3-methoxyphenyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[[(3-methoxyphenyl)thio]methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(3-methoxyphenyl)sulfanylmethyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[[(3-methoxyphenyl)thio]methyl]-2-methyl-3-furoic acid Formula: C14H14O4S MolecularWeight: 278.32356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=CC=CC(=C2)OC)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSC2=CC=CC(=C2)OC)C(=O)O

InChI

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