2-ethyl-2-(thiophen-2-ylmethoxycarbonyl)butanoate

Systemtic Name: 2-ethyl-2-(thiophen-2-ylmethoxycarbonyl)butanoate Openeye Name: 2-ethyl-2-(2-thienylmethoxycarbonyl)butanoate CAS Name: 2-ethyl-2-[oxo(thiophen-2-ylmethoxy)methyl]butanoate IUPAC Name: 2-ethyl-2-(thiophen-2-ylmethoxycarbonyl)butanoate Traditional Name: 2-ethyl-2-(2-thenyloxycarbonyl)butyrate Formula: C12H15O4S- MolecularWeight: 255.3101

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)[O-])C(=O)OCC1=CC=CS1

Isomeric SMILES

CCC(CC)(C(=O)[O-])C(=O)OCC1=CC=CS1

InChI

InChI=1S/C12H16O4S/c1-3-12(4-2,10(13)14)11(15)16-8-9-6-5-7-17-9/h5-7H,3-4,8H2,1-2H3,(H,13,14)/p-1