hexadecan-4-yl adamantane-1-carboxylate

Systemtic Name: hexadecan-4-yl adamantane-1-carboxylate Openeye Name: 1-propyltridecyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid hexadecan-4-yl ester IUPAC Name: hexadecan-4-yl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid 1-propyltridecyl ester Formula: C27H48O2 MolecularWeight: 404.66882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC)OC(=O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCCCCCCCCCCCC(CCC)OC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C27H48O2/c1-3-5-6-7-8-9-10-11-12-13-15-25(14-4-2)29-26(28)27-19-22-16-23(20-27)18-24(17-22)21-27/h22-25H,3-21H2,1-2H3