3-[(4-fluorophenyl)-oxidanyl-methyl]sulfanyl-2-methyl-propanoate

Systemtic Name: 3-[(4-fluorophenyl)-oxidanyl-methyl]sulfanyl-2-methyl-propanoate Openeye Name: 3-[(4-fluorophenyl)-hydroxy-methyl]sulfanyl-2-methyl-propanoate CAS Name: 3-[[(4-fluorophenyl)-hydroxymethyl]thio]-2-methylpropanoate IUPAC Name: 3-[(4-fluorophenyl)-hydroxymethyl]sulfanyl-2-methylpropanoate Traditional Name: 3-[[(4-fluorophenyl)-hydroxy-methyl]thio]-2-methyl-propionate Formula: C11H12FO3S- MolecularWeight: 243.274583

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(C1=CC=C(C=C1)F)O)C(=O)[O-]

Isomeric SMILES

CC(CSC(C1=CC=C(C=C1)F)O)C(=O)[O-]

InChI

InChI=1S/C11H13FO3S/c1-7(10(13)14)6-16-11(15)8-2-4-9(12)5-3-8/h2-5,7,11,15H,6H2,1H3,(H,13,14)/p-1