2-ethylhexyl 3-oxidanylidene-3-thiophen-2-yl-propanoate

Systemtic Name: 2-ethylhexyl 3-oxidanylidene-3-thiophen-2-yl-propanoate Openeye Name: 2-ethylhexyl 3-oxo-3-(2-thienyl)propanoate CAS Name: 3-oxo-3-thiophen-2-ylpropanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 3-oxo-3-thiophen-2-ylpropanoate Traditional Name: 3-keto-3-(2-thienyl)propionic acid 2-ethylhexyl ester Formula: C15H22O3S MolecularWeight: 282.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CC(=O)C1=CC=CS1

Isomeric SMILES

CCCCC(CC)COC(=O)CC(=O)C1=CC=CS1

InChI

InChI=1S/C15H22O3S/c1-3-5-7-12(4-2)11-18-15(17)10-13(16)14-8-6-9-19-14/h6,8-9,12H,3-5,7,10-11H2,1-2H3