dihexyl 5,7-dimethyladamantane-1,3-dicarboxylate

Systemtic Name: dihexyl 5,7-dimethyladamantane-1,3-dicarboxylate Openeye Name: dihexyl 5,7-dimethyladamantane-1,3-dicarboxylate CAS Name: 5,7-dimethyladamantane-1,3-dicarboxylic acid dihexyl ester IUPAC Name: dihexyl 5,7-dimethyladamantane-1,3-dicarboxylate Traditional Name: 5,7-dimethyladamantane-1,3-dicarboxylic acid dihexyl ester Formula: C26H44O4 MolecularWeight: 420.62516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C12CC3(CC(C1)(CC(C3)(C2)C(=O)OCCCCCC)C)C

Isomeric SMILES

CCCCCCOC(=O)C12CC3(CC(C1)(CC(C3)(C2)C(=O)OCCCCCC)C)C

InChI

InChI=1S/C26H44O4/c1-5-7-9-11-13-29-21(27)25-16-23(3)15-24(4,17-25)19-26(18-23,20-25)22(28)30-14-12-10-8-6-2/h5-20H2,1-4H3