2-[4-[[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenoxy]ethyl 2,2-dimethylpropanoate

Systemtic Name: 2-[4-[[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenoxy]ethyl 2,2-dimethylpropanoate Openeye Name: 2-[4-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophene-3-carbonyl]phenoxy]ethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 2-[4-[[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-oxomethyl]phenoxy]ethyl ester IUPAC Name: 2-[4-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophene-3-carbonyl]phenoxy]ethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 2-[4-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophene-3-carbonyl]phenoxy]ethyl ester Formula: C28H26O6S MolecularWeight: 490.56744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O

Isomeric SMILES

CC(C)(C)C(=O)OCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C28H26O6S/c1-28(2,3)27(32)34-15-14-33-21-11-6-17(7-12-21)25(31)24-22-13-10-20(30)16-23(22)35-26(24)18-4-8-19(29)9-5-18/h4-13,16,29-30H,14-15H2,1-3H3