(4-butoxyphenyl)-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]methanone

Systemtic Name: (4-butoxyphenyl)-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]methanone Openeye Name: (4-butoxyphenyl)-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]methanone CAS Name: (4-butoxyphenyl)-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone IUPAC Name: (4-butoxyphenyl)-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone Traditional Name: (4-butoxyphenyl)-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]methanone Formula: C25H22O4S MolecularWeight: 418.50478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C25H22O4S/c1-2-3-14-29-20-11-6-16(7-12-20)24(28)23-21-13-10-19(27)15-22(21)30-25(23)17-4-8-18(26)9-5-17/h4-13,15,26-27H,2-3,14H2,1H3