2-[[(5R,7S)-3-bromanyl-5,7-dimethyl-1-adamantyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(5R,7S)-3-bromanyl-5,7-dimethyl-1-adamantyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(5R,7S)-3-bromo-5,7-dimethyl-adamantane-1-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[(5R,7S)-3-bromo-5,7-dimethyl-1-adamantyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(5R,7S)-3-bromo-5,7-dimethyladamantane-1-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(5R,7S)-3-bromo-5,7-dimethyl-adamantane-1-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C17H30BrN2O+ MolecularWeight: 358.3369

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3(CC(C1)(CC(C2)(C3)Br)C(=O)NCC[NH+](C)C)C

Isomeric SMILES

C[C@@]12C[C@]3(CC(C1)(CC(C2)(C3)Br)C(=O)NCC[NH+](C)C)C

InChI

InChI=1S/C17H29BrN2O/c1-14-7-15(2)9-16(8-14,12-17(18,10-14)11-15)13(21)19-5-6-20(3)4/h5-12H2,1-4H3,(H,19,21)/p+1/t14-,15+,16?,17?