3-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]propanoic acid

Systemtic Name: 3-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]propanoic acid Openeye Name: 3-[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]propanoic acid CAS Name: 3-[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]propanoic acid IUPAC Name: 3-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]propanoic acid Traditional Name: 3-[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]propionic acid Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CCC(=O)O

InChI

InChI=1S/C18H19NO3S/c1-18(2,3)15-10-23-17(19-15)14-9-12-8-11(5-7-16(20)21)4-6-13(12)22-14/h4,6,8-10H,5,7H2,1-3H3,(H,20,21)