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

Systemtic Name: [4-[[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenoxy]methyl 2,2-dimethylpropanoate Openeye Name: [4-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophene-3-carbonyl]phenoxy]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-oxomethyl]phenoxy]methyl ester IUPAC Name: [4-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophene-3-carbonyl]phenoxy]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophene-3-carbonyl]phenoxy]methyl ester Formula: C27H24O6S MolecularWeight: 476.54086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC1=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)OCOC1=CC=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C27H24O6S/c1-27(2,3)26(31)33-15-32-20-11-6-16(7-12-20)24(30)23-21-13-10-19(29)14-22(21)34-25(23)17-4-8-18(28)9-5-17/h4-14,28-29H,15H2,1-3H3