5-[(4-propan-2-ylphenyl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: 5-[(4-propan-2-ylphenyl)sulfanylmethyl]furan-2-carboxylate Openeye Name: 5-[(4-isopropylphenyl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-propan-2-ylphenyl)thio]methyl]-2-furancarboxylate IUPAC Name: 5-[(4-propan-2-ylphenyl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[(p-cumenylthio)methyl]-2-furoate Formula: C15H15O3S- MolecularWeight: 275.3428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SCC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C15H16O3S/c1-10(2)11-3-6-13(7-4-11)19-9-12-5-8-14(18-12)15(16)17/h3-8,10H,9H2,1-2H3,(H,16,17)/p-1