ethyl 4-[(E)-8-(2,6-dimethylphenyl)sulfanyloct-2-enyl]-2-oxidanylidene-oxolane-3-carboxylate

Systemtic Name: ethyl 4-[(E)-8-(2,6-dimethylphenyl)sulfanyloct-2-enyl]-2-oxidanylidene-oxolane-3-carboxylate Openeye Name: ethyl 4-[(E)-8-(2,6-dimethylphenyl)sulfanyloct-2-enyl]-2-oxo-tetrahydrofuran-3-carboxylate CAS Name: 4-[(E)-8-[(2,6-dimethylphenyl)thio]oct-2-enyl]-2-oxo-3-oxolanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-8-(2,6-dimethylphenyl)sulfanyloct-2-enyl]-2-oxooxolane-3-carboxylate Traditional Name: 4-[(E)-8-[(2,6-dimethylphenyl)thio]oct-2-enyl]-2-keto-tetrahydrofuran-3-carboxylic acid ethyl ester Formula: C23H32O4S MolecularWeight: 404.56278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(COC1=O)CC=CCCCCCSC2=C(C=CC=C2C)C

Isomeric SMILES

CCOC(=O)C1C(COC1=O)C/C=C/CCCCCSC2=C(C=CC=C2C)C

InChI

InChI=1S/C23H32O4S/c1-4-26-22(24)20-19(16-27-23(20)25)14-9-7-5-6-8-10-15-28-21-17(2)12-11-13-18(21)3/h7,9,11-13,19-20H,4-6,8,10,14-16H2,1-3H3/b9-7+