heptyl 2-methyl-2-oxidanyl-adamantane-1-carboxylate

Systemtic Name: heptyl 2-methyl-2-oxidanyl-adamantane-1-carboxylate Openeye Name: heptyl 2-hydroxy-2-methyl-adamantane-1-carboxylate CAS Name: 2-hydroxy-2-methyl-1-adamantanecarboxylic acid heptyl ester IUPAC Name: heptyl 2-hydroxy-2-methyladamantane-1-carboxylate Traditional Name: 2-hydroxy-2-methyl-adamantane-1-carboxylic acid heptyl ester Formula: C19H32O3 MolecularWeight: 308.45558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C12CC3CC(C1)CC(C3)C2(C)O

Isomeric SMILES

CCCCCCCOC(=O)C12CC3CC(C1)CC(C3)C2(C)O

InChI

InChI=1S/C19H32O3/c1-3-4-5-6-7-8-22-17(20)19-12-14-9-15(13-19)11-16(10-14)18(19,2)21/h14-16,21H,3-13H2,1-2H3