diethyl 2,5-bis[4-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylate

Systemtic Name: diethyl 2,5-bis[4-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylate Openeye Name: diethyl 2,5-bis[4-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylate CAS Name: 2,5-bis[4-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,5-bis[4-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylate Traditional Name: 2,5-bis[4-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylic acid diethyl ester Formula: C44H62O6 MolecularWeight: 686.95948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1C2=CC=C(C=C2)OCCC(C)CCCC(C)C)C(=O)OCC)C3=CC=C(C=C3)OCCC(C)CCCC(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1C2=CC=C(C=C2)OCCC(C)CCCC(C)C)C(=O)OCC)C3=CC=C(C=C3)OCCC(C)CCCC(C)C

InChI

InChI=1S/C44H62O6/c1-9-47-43(45)41-29-40(36-19-23-38(24-20-36)50-28-26-34(8)16-12-14-32(5)6)42(44(46)48-10-2)30-39(41)35-17-21-37(22-18-35)49-27-25-33(7)15-11-13-31(3)4/h17-24,29-34H,9-16,25-28H2,1-8H3