O2-nonyl O1-undecyl 3-heptylbenzene-1,2-dicarboxylate

Systemtic Name: O2-nonyl O1-undecyl 3-heptylbenzene-1,2-dicarboxylate Openeye Name: O2-nonyl O1-undecyl 3-heptylbenzene-1,2-dicarboxylate CAS Name: 3-heptylbenzene-1,2-dicarboxylic acid O2-nonyl ester O1-undecyl ester IUPAC Name: 2-O-nonyl 1-O-undecyl 3-heptylbenzene-1,2-dicarboxylate Traditional Name: 3-heptylbenzene-1,2-dicarboxylic acid O2-nonyl ester O1-undecyl ester Formula: C35H60O4 MolecularWeight: 544.8485

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=C(C(=CC=C1)CCCCCCC)C(=O)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=C(C(=CC=C1)CCCCCCC)C(=O)OCCCCCCCCC

InChI

InChI=1S/C35H60O4/c1-4-7-10-13-15-16-18-21-23-29-38-34(36)32-28-25-27-31(26-22-19-12-9-6-3)33(32)35(37)39-30-24-20-17-14-11-8-5-2/h25,27-28H,4-24,26,29-30H2,1-3H3