5-(propan-2-ylsulfanylmethyl)furan-2-carboxylic acid

Systemtic Name: 5-(propan-2-ylsulfanylmethyl)furan-2-carboxylic acid Openeye Name: 5-(isopropylsulfanylmethyl)furan-2-carboxylic acid CAS Name: 5-[(propan-2-ylthio)methyl]-2-furancarboxylic acid IUPAC Name: 5-(propan-2-ylsulfanylmethyl)furan-2-carboxylic acid Traditional Name: 5-[(isopropylthio)methyl]-2-furoic acid Formula: C9H12O3S MolecularWeight: 200.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=CC=C(O1)C(=O)O

Isomeric SMILES

CC(C)SCC1=CC=C(O1)C(=O)O

InChI

InChI=1S/C9H12O3S/c1-6(2)13-5-7-3-4-8(12-7)9(10)11/h3-4,6H,5H2,1-2H3,(H,10,11)