(E)-4-[5-(3-tert-butyl-5-ethyl-2-oxidanyl-phenyl)-1-benzofuran-2-yl]but-2-enoic acid

Systemtic Name: (E)-4-[5-(3-tert-butyl-5-ethyl-2-oxidanyl-phenyl)-1-benzofuran-2-yl]but-2-enoic acid Openeye Name: (E)-4-[5-(3-tert-butyl-5-ethyl-2-hydroxy-phenyl)benzofuran-2-yl]but-2-enoic acid CAS Name: (E)-4-[5-(3-tert-butyl-5-ethyl-2-hydroxyphenyl)-2-benzofuranyl]-2-butenoic acid IUPAC Name: (E)-4-[5-(3-tert-butyl-5-ethyl-2-hydroxyphenyl)-1-benzofuran-2-yl]but-2-enoic acid Traditional Name: (E)-4-[5-(3-tert-butyl-5-ethyl-2-hydroxy-phenyl)benzofuran-2-yl]but-2-enoic acid Formula: C24H26O4 MolecularWeight: 378.46084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)C2=CC3=C(C=C2)OC(=C3)CC=CC(=O)O)O)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C(=C1)C2=CC3=C(C=C2)OC(=C3)C/C=C/C(=O)O)O)C(C)(C)C

InChI

InChI=1S/C24H26O4/c1-5-15-11-19(23(27)20(12-15)24(2,3)4)16-9-10-21-17(13-16)14-18(28-21)7-6-8-22(25)26/h6,8-14,27H,5,7H2,1-4H3,(H,25,26)/b8-6+