6,7,10,11-tetrakis(2-ethylhexoxy)triphenylene-1,4-dione

Systemtic Name: 6,7,10,11-tetrakis(2-ethylhexoxy)triphenylene-1,4-dione Openeye Name: 6,7,10,11-tetrakis(2-ethylhexoxy)triphenylene-1,4-dione CAS Name: 6,7,10,11-tetrakis(2-ethylhexoxy)triphenylene-1,4-dione IUPAC Name: 6,7,10,11-tetrakis(2-ethylhexoxy)triphenylene-1,4-dione Traditional Name: 6,7,10,11-tetrakis(2-ethylhexoxy)triphenylene-1,4-quinone Formula: C50H74O6 MolecularWeight: 771.11896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=C2C(=O)C=CC4=O)OCC(CC)CCCC)OCC(CC)CCCC)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=C2C(=O)C=CC4=O)OCC(CC)CCCC)OCC(CC)CCCC)OCC(CC)CCCC

InChI

InChI=1S/C50H74O6/c1-9-17-21-35(13-5)31-53-45-27-39-40-28-46(54-32-36(14-6)22-18-10-2)48(56-34-38(16-8)24-20-12-4)30-42(40)50-44(52)26-25-43(51)49(50)41(39)29-47(45)55-33-37(15-7)23-19-11-3/h25-30,35-38H,9-24,31-34H2,1-8H3