2-[(2-methyl-2-phenyl-1,3-dioxolan-4-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(2-methyl-2-phenyl-1,3-dioxolan-4-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2-methyl-2-phenyl-1,3-dioxolan-4-yl)methylsulfanyl]acetic acid CAS Name: 2-[(2-methyl-2-phenyl-1,3-dioxolan-4-yl)methylthio]acetic acid IUPAC Name: 2-[(2-methyl-2-phenyl-1,3-dioxolan-4-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(2-methyl-2-phenyl-1,3-dioxolan-4-yl)methylthio]acetic acid Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CSCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1(OCC(O1)CSCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C13H16O4S/c1-13(10-5-3-2-4-6-10)16-7-11(17-13)8-18-9-12(14)15/h2-6,11H,7-9H2,1H3,(H,14,15)