ethyl 3-oxidanylidene-2-propan-2-yl-4-thiophen-2-yl-butanoate

Systemtic Name: ethyl 3-oxidanylidene-2-propan-2-yl-4-thiophen-2-yl-butanoate Openeye Name: ethyl 2-isopropyl-3-oxo-4-(2-thienyl)butanoate CAS Name: 3-oxo-2-propan-2-yl-4-thiophen-2-ylbutanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-2-propan-2-yl-4-thiophen-2-ylbutanoate Traditional Name: 2-isopropyl-3-keto-4-(2-thienyl)butyric acid ethyl ester Formula: C13H18O3S MolecularWeight: 254.34522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3S/c1-4-16-13(15)12(9(2)3)11(14)8-10-6-5-7-17-10/h5-7,9,12H,4,8H2,1-3H3