5-[(4-methylphenyl)methylsulfinylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(4-methylphenyl)methylsulfinylmethyl]furan-2-carboxylic acid Openeye Name: 5-(p-tolylmethylsulfinylmethyl)furan-2-carboxylic acid CAS Name: 5-[(4-methylphenyl)methylsulfinylmethyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-methylphenyl)methylsulfinylmethyl]furan-2-carboxylic acid Traditional Name: 5-[(4-methylbenzyl)sulfinylmethyl]-2-furoic acid Formula: C14H14O4S MolecularWeight: 278.32356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14O4S/c1-10-2-4-11(5-3-10)8-19(17)9-12-6-7-13(18-12)14(15)16/h2-7H,8-9H2,1H3,(H,15,16)