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

Systemtic Name: diethyl 2,5-bis[3-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylate Openeye Name: diethyl 2,5-bis[3-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylate CAS Name: 2,5-bis[3-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,5-bis[3-(3,7-dimethyloctoxy)phenyl]benzene-1,4-dicarboxylate Traditional Name: 2,5-bis[3-(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(=CC=C2)OCCC(C)CCCC(C)C)C(=O)OCC)C3=CC(=CC=C3)OCCC(C)CCCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C44H62O6/c1-9-47-43(45)41-29-40(36-20-14-22-38(28-36)50-26-24-34(8)18-12-16-32(5)6)42(44(46)48-10-2)30-39(41)35-19-13-21-37(27-35)49-25-23-33(7)17-11-15-31(3)4/h13-14,19-22,27-34H,9-12,15-18,23-26H2,1-8H3