4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-2-(thiophen-2-ylmethyl)butanoic acid

Systemtic Name: 4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-2-(thiophen-2-ylmethyl)butanoic acid Openeye Name: 4-tert-butoxy-4-oxo-2-(2-thienylmethyl)butanoic acid CAS Name: 4-[(2-methylpropan-2-yl)oxy]-4-oxo-2-(thiophen-2-ylmethyl)butanoic acid IUPAC Name: 4-[(2-methylpropan-2-yl)oxy]-4-oxo-2-(thiophen-2-ylmethyl)butanoic acid Traditional Name: 4-tert-butoxy-4-keto-2-(2-thenyl)butyric acid Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CC1=CC=CS1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(CC1=CC=CS1)C(=O)O

InChI

InChI=1S/C13H18O4S/c1-13(2,3)17-11(14)8-9(12(15)16)7-10-5-4-6-18-10/h4-6,9H,7-8H2,1-3H3,(H,15,16)