O2-(2-adamantyl) O1-octyl benzene-1,2-dicarboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C26H36O4/c1-2-3-4-5-6-9-12-29-25(27)22-10-7-8-11-23(22)26(28)30-24-20-14-18-13-19(16-20)17-21(24)15-18/h7-8,10-11,18-21,24H,2-6,9,12-17H2,1H3