O2-heptyl O1-nonyl 3,4-diheptylbenzene-1,2-dicarboxylate

Systemtic Name: O2-heptyl O1-nonyl 3,4-diheptylbenzene-1,2-dicarboxylate Openeye Name: O2-heptyl O1-nonyl 3,4-diheptylbenzene-1,2-dicarboxylate CAS Name: 3,4-diheptylbenzene-1,2-dicarboxylic acid O2-heptyl ester O1-nonyl ester IUPAC Name: 2-O-heptyl 1-O-nonyl 3,4-diheptylbenzene-1,2-dicarboxylate Traditional Name: 3,4-diheptylbenzene-1,2-dicarboxylic acid O2-heptyl ester O1-nonyl ester Formula: C38H66O4 MolecularWeight: 586.92824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C1=C(C(=C(C=C1)CCCCCCC)CCCCCCC)C(=O)OCCCCCCC

Isomeric SMILES

CCCCCCCCCOC(=O)C1=C(C(=C(C=C1)CCCCCCC)CCCCCCC)C(=O)OCCCCCCC

InChI

InChI=1S/C38H66O4/c1-5-9-13-17-18-22-26-31-41-37(39)35-30-29-33(27-23-19-14-10-6-2)34(28-24-20-15-11-7-3)36(35)38(40)42-32-25-21-16-12-8-4/h29-30H,5-28,31-32H2,1-4H3