O4-[(E)-docos-13-enyl] O1-octadecyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(E)-docos-13-enyl] O1-octadecyl benzene-1,4-dicarboxylate Openeye Name: O4-[(E)-docos-13-enyl] O1-octadecyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[(E)-docos-13-enyl] ester O1-octadecyl ester IUPAC Name: 4-O-[(E)-docos-13-enyl] 1-O-octadecyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(E)-docos-13-enyl] ester O1-stearyl ester Formula: C48H84O4 MolecularWeight: 725.17816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C48H84O4/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-44-52-48(50)46-41-39-45(40-42-46)47(49)51-43-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h17,19,39-42H,3-16,18,20-38,43-44H2,1-2H3/b19-17+