2-(carboxymethylsulfanylmethyl)-5-phenyl-furan-3-carboxylic acid

Systemtic Name: 2-(carboxymethylsulfanylmethyl)-5-phenyl-furan-3-carboxylic acid Openeye Name: 2-(carboxymethylsulfanylmethyl)-5-phenyl-furan-3-carboxylic acid CAS Name: 2-[(carboxymethylthio)methyl]-5-phenyl-3-furancarboxylic acid IUPAC Name: 2-(carboxymethylsulfanylmethyl)-5-phenylfuran-3-carboxylic acid Traditional Name: 2-[(carboxymethylthio)methyl]-5-phenyl-3-furoic acid Formula: C14H12O5S MolecularWeight: 292.30708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(O2)CSCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(O2)CSCC(=O)O)C(=O)O

InChI

InChI=1S/C14H12O5S/c15-13(16)8-20-7-12-10(14(17)18)6-11(19-12)9-4-2-1-3-5-9/h1-6H,7-8H2,(H,15,16)(H,17,18)