5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-carboxylic acid

Systemtic Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-carboxylic acid Openeye Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2,2-dimethyl-3H-benzofuran-7-carboxylic acid CAS Name: 5-[2-(3,4-diethoxyphenyl)-4-thiazolyl]-2,2-dimethyl-3H-benzofuran-7-carboxylic acid IUPAC Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2,2-dimethyl-3H-1-benzofuran-7-carboxylic acid Traditional Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2,2-dimethyl-coumaran-7-carboxylic acid Formula: C24H25NO5S MolecularWeight: 439.524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C4C(=C3)CC(O4)(C)C)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C4C(=C3)CC(O4)(C)C)C(=O)O)OCC

InChI

InChI=1S/C24H25NO5S/c1-5-28-19-8-7-14(11-20(19)29-6-2)22-25-18(13-31-22)15-9-16-12-24(3,4)30-21(16)17(10-15)23(26)27/h7-11,13H,5-6,12H2,1-4H3,(H,26,27)