2-[(5S,7R)-2-(3-oxidanylidenebutyl)-1-adamantyl]ethyl methanesulfonate

Systemtic Name: 2-[(5S,7R)-2-(3-oxidanylidenebutyl)-1-adamantyl]ethyl methanesulfonate Openeye Name: 2-[(5S,7R)-2-(3-oxobutyl)-1-adamantyl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[(5S,7R)-2-(3-oxobutyl)-1-adamantyl]ethyl ester IUPAC Name: 2-[(5S,7R)-2-(3-oxobutyl)-1-adamantyl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[(5S,7R)-2-(3-ketobutyl)-1-adamantyl]ethyl ester Formula: C17H28O4S MolecularWeight: 328.46682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1C2CC3CC(C2)CC1(C3)CCOS(=O)(=O)C

Isomeric SMILES

CC(=O)CCC1C2C[C@H]3C[C@@H](C2)CC1(C3)CCOS(=O)(=O)C

InChI

InChI=1S/C17H28O4S/c1-12(18)3-4-16-15-8-13-7-14(9-15)11-17(16,10-13)5-6-21-22(2,19)20/h13-16H,3-11H2,1-2H3/t13-,14+,15?,16?,17?