ethyl 4-oxidanylidene-5-(3-phenylmethoxypropyl)thiolane-3-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-5-(3-phenylmethoxypropyl)thiolane-3-carboxylate Openeye Name: ethyl 5-(3-benzyloxypropyl)-4-oxo-tetrahydrothiophene-3-carboxylate CAS Name: 4-oxo-5-(3-phenylmethoxypropyl)-3-thiolanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-5-(3-phenylmethoxypropyl)thiolane-3-carboxylate Traditional Name: 5-(3-benzoxypropyl)-4-keto-tetrahydrothiophene-3-carboxylic acid ethyl ester Formula: C17H22O4S MolecularWeight: 322.41918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(C1=O)CCCOCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CSC(C1=O)CCCOCC2=CC=CC=C2

InChI

InChI=1S/C17H22O4S/c1-2-21-17(19)14-12-22-15(16(14)18)9-6-10-20-11-13-7-4-3-5-8-13/h3-5,7-8,14-15H,2,6,9-12H2,1H3