methyl 4-oxidanylidene-5-phenyl-thiolane-3-carboxylate

Systemtic Name: methyl 4-oxidanylidene-5-phenyl-thiolane-3-carboxylate Openeye Name: methyl 4-oxo-5-phenyl-tetrahydrothiophene-3-carboxylate CAS Name: 4-oxo-5-phenyl-3-thiolanecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-5-phenylthiolane-3-carboxylate Traditional Name: 4-keto-5-phenyl-tetrahydrothiophene-3-carboxylic acid methyl ester Formula: C12H12O3S MolecularWeight: 236.28688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSC(C1=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1CSC(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12O3S/c1-15-12(14)9-7-16-11(10(9)13)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3