2-[4-[(E)-4-[2-[4-[4-(4-hydroxyphenyl)sulfonylphenoxy]phenyl]sulfonyl-6-propoxy-phenoxy]but-2-enoxy]phenyl]sulfonylphenol

Systemtic Name: 2-[4-[(E)-4-[2-[4-[4-(4-hydroxyphenyl)sulfonylphenoxy]phenyl]sulfonyl-6-propoxy-phenoxy]but-2-enoxy]phenyl]sulfonylphenol Openeye Name: 2-[4-[(E)-4-[2-[4-[4-(4-hydroxyphenyl)sulfonylphenoxy]phenyl]sulfonyl-6-propoxy-phenoxy]but-2-enoxy]phenyl]sulfonylphenol CAS Name: 2-[4-[(E)-4-[2-[4-[4-(4-hydroxyphenyl)sulfonylphenoxy]phenyl]sulfonyl-6-propoxyphenoxy]but-2-enoxy]phenyl]sulfonylphenol IUPAC Name: 2-[4-[(E)-4-[2-[4-[4-(4-hydroxyphenyl)sulfonylphenoxy]phenyl]sulfonyl-6-propoxyphenoxy]but-2-enoxy]phenyl]sulfonylphenol Traditional Name: 2-[4-[(E)-4-[2-[4-[4-(4-hydroxyphenyl)sulfonylphenoxy]phenyl]sulfonyl-6-propoxy-phenoxy]but-2-enoxy]phenyl]sulfonylphenol Formula: C43H38O12S3 MolecularWeight: 842.94962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C(=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)O)OCC=CCOC5=CC=C(C=C5)S(=O)(=O)C6=CC=CC=C6O

Isomeric SMILES

CCCOC1=C(C(=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)O)OC/C=C/COC5=CC=C(C=C5)S(=O)(=O)C6=CC=CC=C6O

InChI

InChI=1S/C43H38O12S3/c1-2-28-53-40-9-7-11-42(43(40)54-30-6-5-29-52-32-14-22-37(23-15-32)57(48,49)41-10-4-3-8-39(41)45)58(50,51)38-26-18-34(19-27-38)55-33-16-24-36(25-17-33)56(46,47)35-20-12-31(44)13-21-35/h3-27,44-45H,2,28-30H2,1H3/b6-5+