O2-[2-(1-adamantyl)ethyl] O1-hexyl benzene-1,2-dicarboxylate

Systemtic Name: O2-[2-(1-adamantyl)ethyl] O1-hexyl benzene-1,2-dicarboxylate Openeye Name: O2-[2-(1-adamantyl)ethyl] O1-hexyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O2-[2-(1-adamantyl)ethyl] ester O1-hexyl ester IUPAC Name: 2-O-[2-(1-adamantyl)ethyl] 1-O-hexyl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O2-[2-(1-adamantyl)ethyl] ester O1-hexyl ester Formula: C26H36O4 MolecularWeight: 412.56164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C26H36O4/c1-2-3-4-7-11-29-24(27)22-8-5-6-9-23(22)25(28)30-12-10-26-16-19-13-20(17-26)15-21(14-19)18-26/h5-6,8-9,19-21H,2-4,7,10-18H2,1H3