O-(4-ethylphenyl) 2-(4-butylphenyl)-1,3-dioxane-5-carbothioate

Systemtic Name: O-(4-ethylphenyl) 2-(4-butylphenyl)-1,3-dioxane-5-carbothioate Openeye Name: O-(4-ethylphenyl) 2-(4-butylphenyl)-1,3-dioxane-5-carbothioate CAS Name: 2-(4-butylphenyl)-1,3-dioxane-5-carbothioic acid O-(4-ethylphenyl) ester IUPAC Name: O-(4-ethylphenyl) 2-(4-butylphenyl)-1,3-dioxane-5-carbothioate Traditional Name: 2-(4-butylphenyl)-1,3-dioxane-5-carbothioic acid O-(4-ethylphenyl) ester Formula: C23H28O3S MolecularWeight: 384.53162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2OCC(CO2)C(=S)OC3=CC=C(C=C3)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2OCC(CO2)C(=S)OC3=CC=C(C=C3)CC

InChI

InChI=1S/C23H28O3S/c1-3-5-6-18-7-11-19(12-8-18)22-24-15-20(16-25-22)23(27)26-21-13-9-17(4-2)10-14-21/h7-14,20,22H,3-6,15-16H2,1-2H3