bis(18-methylnonadecyl) benzene-1,4-dicarboxylate

Systemtic Name: bis(18-methylnonadecyl) benzene-1,4-dicarboxylate Openeye Name: bis(18-methylnonadecyl) benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis(18-methylnonadecyl) ester IUPAC Name: bis(18-methylnonadecyl) benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis(18-methylnonadecyl) ester Formula: C48H86O4 MolecularWeight: 727.19404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCCCCCCCCCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCCCCCCCCCCCCCCC(C)C

InChI

InChI=1S/C48H86O4/c1-43(2)35-31-27-23-19-15-11-7-5-9-13-17-21-25-29-33-41-51-47(49)45-37-39-46(40-38-45)48(50)52-42-34-30-26-22-18-14-10-6-8-12-16-20-24-28-32-36-44(3)4/h37-40,43-44H,5-36,41-42H2,1-4H3