bis(8-methylnonyl) benzene-1,2-dicarboxylate; ditridecyl benzene-1,2-dicarboxylate

Systemtic Name: bis(8-methylnonyl) benzene-1,2-dicarboxylate; ditridecyl benzene-1,2-dicarboxylate Openeye Name: bis(8-methylnonyl) benzene-1,2-dicarboxylate; ditridecyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(8-methylnonyl) ester; benzene-1,2-dicarboxylic acid ditridecyl ester IUPAC Name: bis(8-methylnonyl) benzene-1,2-dicarboxylate; ditridecyl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(8-methylnonyl) ester; benzene-1,2-dicarboxylic acid ditridecyl ester Formula: C62H104O8 MolecularWeight: 977.48436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCCC.CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCCC.CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C

InChI

InChI=1S/C34H58O4.C28H46O4/c1-3-5-7-9-11-13-15-17-19-21-25-29-37-33(35)31-27-23-24-28-32(31)34(36)38-30-26-22-20-18-16-14-12-10-8-6-4-2;1-23(2)17-11-7-5-9-15-21-31-27(29)25-19-13-14-20-26(25)28(30)32-22-16-10-6-8-12-18-24(3)4/h23-24,27-28H,3-22,25-26,29-30H2,1-2H3;13-14,19-20,23-24H,5-12,15-18,21-22H2,1-4H3