[2-(diethylamino)-2-oxidanylidene-ethyl] (5R,7R)-3-bromanyladamantane-1-carboxylate

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] (5R,7R)-3-bromanyladamantane-1-carboxylate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] (5R,7R)-3-bromoadamantane-1-carboxylate CAS Name: (5R,7R)-3-bromo-1-adamantanecarboxylic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] (5R,7R)-3-bromoadamantane-1-carboxylate Traditional Name: (5R,7R)-3-bromoadamantane-1-carboxylic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C17H26BrNO3 MolecularWeight: 372.29724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)Br

Isomeric SMILES

CCN(CC)C(=O)COC(=O)C12C[C@H]3C[C@H](C1)CC(C3)(C2)Br

InChI

InChI=1S/C17H26BrNO3/c1-3-19(4-2)14(20)10-22-15(21)16-6-12-5-13(7-16)9-17(18,8-12)11-16/h12-13H,3-11H2,1-2H3/t12-,13-,16?,17?/m1/s1