methyl 3-(1-adamantyl)-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-(1-adamantyl)-3-oxidanylidene-propanoate Openeye Name: methyl 3-(1-adamantyl)-3-oxo-propanoate CAS Name: 3-(1-adamantyl)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(1-adamantyl)-3-oxopropanoate Traditional Name: 3-(1-adamantyl)-3-keto-propionic acid methyl ester Formula: C14H20O3 MolecularWeight: 236.3068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

COC(=O)CC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C14H20O3/c1-17-13(16)5-12(15)14-6-9-2-10(7-14)4-11(3-9)8-14/h9-11H,2-8H2,1H3