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

Systemtic Name: O2-(1-adamantylmethyl) O1-octyl benzene-1,2-dicarboxylate Openeye Name: O2-(1-adamantylmethyl) O1-octyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O2-(1-adamantylmethyl) ester O1-octyl ester IUPAC Name: 2-O-(1-adamantylmethyl) 1-O-octyl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O2-(1-adamantylmethyl) ester O1-octyl ester Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H38O4/c1-2-3-4-5-6-9-12-30-25(28)23-10-7-8-11-24(23)26(29)31-19-27-16-20-13-21(17-27)15-22(14-20)18-27/h7-8,10-11,20-22H,2-6,9,12-19H2,1H3