tris[4-[(E)-2-(4-hexoxyphenyl)ethenyl]phenyl]methanol

Systemtic Name: tris[4-[(E)-2-(4-hexoxyphenyl)ethenyl]phenyl]methanol Openeye Name: tris[4-[(E)-2-(4-hexoxyphenyl)vinyl]phenyl]methanol CAS Name: tris[4-[(E)-2-(4-hexoxyphenyl)ethenyl]phenyl]methanol IUPAC Name: tris[4-[(E)-2-(4-hexoxyphenyl)ethenyl]phenyl]methanol Traditional Name: tris[4-[(E)-2-(4-hexoxyphenyl)vinyl]phenyl]methanol Formula: C61H70O4 MolecularWeight: 867.2061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)C(C3=CC=C(C=C3)C=CC4=CC=C(C=C4)OCCCCCC)(C5=CC=C(C=C5)C=CC6=CC=C(C=C6)OCCCCCC)O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C(O)(C3=CC=C(C=C3)/C=C/C4=CC=C(C=C4)OCCCCCC)C5=CC=C(C=C5)/C=C/C6=CC=C(C=C6)OCCCCCC

InChI

InChI=1S/C61H70O4/c1-4-7-10-13-46-63-58-40-28-52(29-41-58)19-16-49-22-34-55(35-23-49)61(62,56-36-24-50(25-37-56)17-20-53-30-42-59(43-31-53)64-47-14-11-8-5-2)57-38-26-51(27-39-57)18-21-54-32-44-60(45-33-54)65-48-15-12-9-6-3/h16-45,62H,4-15,46-48H2,1-3H3/b19-16+,20-17+,21-18+