dimethyl 2,5-bis(9,9-dioctylfluoren-2-yl)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2,5-bis(9,9-dioctylfluoren-2-yl)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2,5-bis(9,9-dioctylfluoren-2-yl)benzene-1,4-dicarboxylate CAS Name: 2,5-bis(9,9-dioctyl-2-fluorenyl)benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,5-bis(9,9-dioctylfluoren-2-yl)benzene-1,4-dicarboxylate Traditional Name: 2,5-bis(9,9-dioctylfluoren-2-yl)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C68H90O4 MolecularWeight: 971.4398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C2=CC=CC=C2C3=C1C=C(C=C3)C4=CC(=C(C=C4C(=O)OC)C5=CC6=C(C=C5)C7=CC=CC=C7C6(CCCCCCCC)CCCCCCCC)C(=O)OC)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1(C2=CC=CC=C2C3=C1C=C(C=C3)C4=CC(=C(C=C4C(=O)OC)C5=CC6=C(C=C5)C7=CC=CC=C7C6(CCCCCCCC)CCCCCCCC)C(=O)OC)CCCCCCCC

InChI

InChI=1S/C68H90O4/c1-7-11-15-19-23-31-43-67(44-32-24-20-16-12-8-2)61-37-29-27-35-53(61)55-41-39-51(47-63(55)67)57-49-60(66(70)72-6)58(50-59(57)65(69)71-5)52-40-42-56-54-36-28-30-38-62(54)68(64(56)48-52,45-33-25-21-17-13-9-3)46-34-26-22-18-14-10-4/h27-30,35-42,47-50H,7-26,31-34,43-46H2,1-6H3