[4-(1-benzothiophen-3-ylcarbonyl)-3-(4-hydroxyphenyl)-5-oxidanyl-phenoxy]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-(1-benzothiophen-3-ylcarbonyl)-3-(4-hydroxyphenyl)-5-oxidanyl-phenoxy]methyl 2,2-dimethylpropanoate Openeye Name: [4-(benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[1-benzothiophen-3-yl(oxo)methyl]-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]methyl ester IUPAC Name: [4-(1-benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-(benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)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)C2=CC=C(C=C2)O)C(=O)C3=CSC4=CC=CC=C43)O

Isomeric SMILES

CC(C)(C)C(=O)OCOC1=CC(=C(C(=C1)C2=CC=C(C=C2)O)C(=O)C3=CSC4=CC=CC=C43)O

InChI

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