O4-[(E)-octadec-9-enoyl] O1-octadecyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(E)-octadec-9-enoyl] O1-octadecyl benzene-1,4-dicarboxylate Openeye Name: O4-[(E)-octadec-9-enoyl] O1-octadecyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-octadecyl ester O4-[(E)-1-oxooctadec-9-enyl] ester IUPAC Name: 4-O-[(E)-octadec-9-enoyl] 1-O-octadecyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(E)-octadec-9-enoyl] ester O1-stearyl ester Formula: C44H74O5 MolecularWeight: 683.05536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C44H74O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-48-43(46)40-35-37-41(38-36-40)44(47)49-42(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20,35-38H,3-17,19,21-34,39H2,1-2H3/b20-18+