5-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[(2,5-dimethylphenyl)sulfonylmethyl]-2-methyl-3-furoic acid Formula: C15H16O5S MolecularWeight: 308.34954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)CC2=CC(=C(O2)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)CC2=CC(=C(O2)C)C(=O)O

InChI

InChI=1S/C15H16O5S/c1-9-4-5-10(2)14(6-9)21(18,19)8-12-7-13(15(16)17)11(3)20-12/h4-7H,8H2,1-3H3,(H,16,17)