4-[9,10,11-trihexoxy-1,12-bis(4-prop-2-enoyloxybutoxy)triphenylen-2-yl]oxybutyl prop-2-enoate

Systemtic Name: 4-[9,10,11-trihexoxy-1,12-bis(4-prop-2-enoyloxybutoxy)triphenylen-2-yl]oxybutyl prop-2-enoate Openeye Name: 4-[9,10,11-trihexoxy-1,12-bis(4-prop-2-enoyloxybutoxy)triphenylen-2-yl]oxybutyl prop-2-enoate CAS Name: 2-propenoic acid 4-[[9,10,11-trihexoxy-1,12-bis[4-(1-oxoprop-2-enoxy)butoxy]-2-triphenylenyl]oxy]butyl ester IUPAC Name: 4-[9,10,11-trihexoxy-1,12-bis(4-prop-2-enoyloxybutoxy)triphenylen-2-yl]oxybutyl prop-2-enoate Traditional Name: acrylic acid 4-[1,12-bis(4-acryloyloxybutoxy)-9,10,11-trihexoxy-triphenylen-2-yl]oxybutyl ester Formula: C57H78O12 MolecularWeight: 955.22202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=C(C2=C1C3=CC=CC=C3C4=C2C(=C(C=C4)OCCCCOC(=O)C=C)OCCCCOC(=O)C=C)OCCCCOC(=O)C=C)OCCCCCC)OCCCCCC

Isomeric SMILES

CCCCCCOC1=C(C(=C(C2=C1C3=CC=CC=C3C4=C2C(=C(C=C4)OCCCCOC(=O)C=C)OCCCCOC(=O)C=C)OCCCCOC(=O)C=C)OCCCCCC)OCCCCCC

InChI

InChI=1S/C57H78O12/c1-7-13-16-21-38-66-54-51-44-31-20-19-30-43(44)45-32-33-46(61-34-24-25-35-62-47(58)10-4)53(65-41-28-26-36-63-48(59)11-5)50(45)52(51)55(67-42-29-27-37-64-49(60)12-6)57(69-40-23-18-15-9-3)56(54)68-39-22-17-14-8-2/h10-12,19-20,30-33H,4-9,13-18,21-29,34-42H2,1-3H3