4-[(3-ethoxyphenyl)sulfanylmethyl]-5-methyl-furan-2-carboxylic acid

Systemtic Name: 4-[(3-ethoxyphenyl)sulfanylmethyl]-5-methyl-furan-2-carboxylic acid Openeye Name: 4-[(3-ethoxyphenyl)sulfanylmethyl]-5-methyl-furan-2-carboxylic acid CAS Name: 4-[[(3-ethoxyphenyl)thio]methyl]-5-methyl-2-furancarboxylic acid IUPAC Name: 4-[(3-ethoxyphenyl)sulfanylmethyl]-5-methylfuran-2-carboxylic acid Traditional Name: 5-methyl-4-[(m-phenetylthio)methyl]-2-furoic acid Formula: C15H16O4S MolecularWeight: 292.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC=C1)SCC2=C(OC(=C2)C(=O)O)C

Isomeric SMILES

CCOC1=CC(=CC=C1)SCC2=C(OC(=C2)C(=O)O)C

InChI

InChI=1S/C15H16O4S/c1-3-18-12-5-4-6-13(8-12)20-9-11-7-14(15(16)17)19-10(11)2/h4-8H,3,9H2,1-2H3,(H,16,17)