5-(2-methylsulfanylpropyl)-3-(2-phenylethanoyl)oxolane-2,4-dione

Systemtic Name: 5-(2-methylsulfanylpropyl)-3-(2-phenylethanoyl)oxolane-2,4-dione Openeye Name: 5-(2-methylsulfanylpropyl)-3-(2-phenylacetyl)tetrahydrofuran-2,4-dione CAS Name: 5-[2-(methylthio)propyl]-3-(1-oxo-2-phenylethyl)oxolane-2,4-dione IUPAC Name: 5-(2-methylsulfanylpropyl)-3-(2-phenylacetyl)oxolane-2,4-dione Traditional Name: 5-[2-(methylthio)propyl]-3-(2-phenylacetyl)tetrahydrofuran-2,4-quinone Formula: C16H18O4S MolecularWeight: 306.37672

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1C(=O)C(C(=O)O1)C(=O)CC2=CC=CC=C2)SC

Isomeric SMILES

CC(CC1C(=O)C(C(=O)O1)C(=O)CC2=CC=CC=C2)SC

InChI

InChI=1S/C16H18O4S/c1-10(21-2)8-13-15(18)14(16(19)20-13)12(17)9-11-6-4-3-5-7-11/h3-7,10,13-14H,8-9H2,1-2H3