2-[(2R,5S)-5-(phenylsulfanylmethyl)oxolan-2-yl]ethanoic acid

Systemtic Name: 2-[(2R,5S)-5-(phenylsulfanylmethyl)oxolan-2-yl]ethanoic acid Openeye Name: 2-[(2R,5S)-5-(phenylsulfanylmethyl)tetrahydrofuran-2-yl]acetic acid CAS Name: 2-[(2R,5S)-5-[(phenylthio)methyl]-2-oxolanyl]acetic acid IUPAC Name: 2-[(2R,5S)-5-(phenylsulfanylmethyl)oxolan-2-yl]acetic acid Traditional Name: 2-[(2R,5S)-5-[(phenylthio)methyl]tetrahydrofuran-2-yl]acetic acid Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1CC(=O)O)CSC2=CC=CC=C2

Isomeric SMILES

C1C[C@H](O[C@H]1CC(=O)O)CSC2=CC=CC=C2

InChI

InChI=1S/C13H16O3S/c14-13(15)8-10-6-7-11(16-10)9-17-12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H,14,15)/t10-,11+/m1/s1