methyl 3-[2-phenyl-4-(sulfanylmethyl)-1,3-oxathiolan-2-yl]propanoate

Systemtic Name: methyl 3-[2-phenyl-4-(sulfanylmethyl)-1,3-oxathiolan-2-yl]propanoate Openeye Name: methyl 3-[2-phenyl-4-(sulfanylmethyl)-1,3-oxathiolan-2-yl]propanoate CAS Name: 3-[4-(mercaptomethyl)-2-phenyl-1,3-oxathiolan-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-phenyl-4-(sulfanylmethyl)-1,3-oxathiolan-2-yl]propanoate Traditional Name: 3-[4-(mercaptomethyl)-2-phenyl-1,3-oxathiolan-2-yl]propionic acid methyl ester Formula: C14H18O3S2 MolecularWeight: 298.42092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1(OCC(S1)CS)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC1(OCC(S1)CS)C2=CC=CC=C2

InChI

InChI=1S/C14H18O3S2/c1-16-13(15)7-8-14(11-5-3-2-4-6-11)17-9-12(10-18)19-14/h2-6,12,18H,7-10H2,1H3