2-ethyl-2-(2-oxidanyl-5-thiophen-2-ylcarbonyl-phenyl)butanoic acid

Systemtic Name: 2-ethyl-2-(2-oxidanyl-5-thiophen-2-ylcarbonyl-phenyl)butanoic acid Openeye Name: 2-ethyl-2-[2-hydroxy-5-(thiophene-2-carbonyl)phenyl]butanoic acid CAS Name: 2-ethyl-2-[2-hydroxy-5-[oxo(thiophen-2-yl)methyl]phenyl]butanoic acid IUPAC Name: 2-ethyl-2-[2-hydroxy-5-(thiophene-2-carbonyl)phenyl]butanoic acid Traditional Name: 2-ethyl-2-[2-hydroxy-5-(2-thenoyl)phenyl]butyric acid Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=C(C=CC(=C1)C(=O)C2=CC=CS2)O)C(=O)O

Isomeric SMILES

CCC(CC)(C1=C(C=CC(=C1)C(=O)C2=CC=CS2)O)C(=O)O

InChI

InChI=1S/C17H18O4S/c1-3-17(4-2,16(20)21)12-10-11(7-8-13(12)18)15(19)14-6-5-9-22-14/h5-10,18H,3-4H2,1-2H3,(H,20,21)