methyl 3-[(3R,5S)-3,5-dimethyl-1-adamantyl]-2-methyl-2-oxidanyl-propanoate

Systemtic Name: methyl 3-[(3R,5S)-3,5-dimethyl-1-adamantyl]-2-methyl-2-oxidanyl-propanoate Openeye Name: methyl 3-[(3R,5S)-3,5-dimethyl-1-adamantyl]-2-hydroxy-2-methyl-propanoate CAS Name: 3-[(3R,5S)-3,5-dimethyl-1-adamantyl]-2-hydroxy-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-[(3R,5S)-3,5-dimethyl-1-adamantyl]-2-hydroxy-2-methylpropanoate Traditional Name: 3-[(3R,5S)-3,5-dimethyl-1-adamantyl]-2-hydroxy-2-methyl-propionic acid methyl ester Formula: C17H28O3 MolecularWeight: 280.40242

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)CC(C)(C(=O)OC)O)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)CC(C)(C(=O)OC)O)C

InChI

InChI=1S/C17H28O3/c1-14-5-12-6-15(2,8-14)10-17(7-12,9-14)11-16(3,19)13(18)20-4/h12,19H,5-11H2,1-4H3/t12?,14-,15+,16?,17?