3-(carboxymethylsulfanyl)-3-phenyl-propanoic acid

Systemtic Name: 3-(carboxymethylsulfanyl)-3-phenyl-propanoic acid Openeye Name: 3-(carboxymethylsulfanyl)-3-phenyl-propanoic acid CAS Name: 3-(carboxymethylthio)-3-phenylpropanoic acid IUPAC Name: 3-(carboxymethylsulfanyl)-3-phenylpropanoic acid Traditional Name: 3-(carboxymethylthio)-3-phenyl-propionic acid Formula: C11H12O4S MolecularWeight: 240.27558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)SCC(=O)O

InChI

InChI=1S/C11H12O4S/c12-10(13)6-9(16-7-11(14)15)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)(H,14,15)