bis[3-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-1-benzothiophen-2-yl]methanone

Systemtic Name: bis[3-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-1-benzothiophen-2-yl]methanone Openeye Name: bis[3-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)benzothiophen-2-yl]methanone CAS Name: bis[3-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-1-benzothiophen-2-yl]methanone IUPAC Name: bis[3-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-1-benzothiophen-2-yl]methanone Traditional Name: bis[3-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)benzothiophen-2-yl]methanone Formula: C41H26O5S2 MolecularWeight: 662.77214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(SC3=CC=CC(=C32)C4=CC=C(C=C4)O)C(=O)C5=C(C6=C(C=CC=C6S5)C7=CC=C(C=C7)O)C8=CC=CC=C8O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(SC3=CC=CC(=C32)C4=CC=C(C=C4)O)C(=O)C5=C(C6=C(C=CC=C6S5)C7=CC=C(C=C7)O)C8=CC=CC=C8O)O

InChI

InChI=1S/C41H26O5S2/c42-25-19-15-23(16-20-25)27-9-5-13-33-35(27)37(29-7-1-3-11-31(29)44)40(47-33)39(46)41-38(30-8-2-4-12-32(30)45)36-28(10-6-14-34(36)48-41)24-17-21-26(43)22-18-24/h1-22,42-45H