[3-[[(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]azaniumyl]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl]azaniumyl]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl]ammonio]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl]azaniumyl]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C20H39N3O+2 MolecularWeight: 337.54316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)[NH2+]CC(C)(C)C[NH+](C)C

Isomeric SMILES

C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)[NH2+]CC(C)(C)C[NH+](C)C

InChI

InChI=1S/C20H37N3O/c1-14(21-12-19(2,3)13-23(4)5)18(24)22-20-9-15-6-16(10-20)8-17(7-15)11-20/h14-17,21H,6-13H2,1-5H3,(H,22,24)/p+2/t14-,15?,16?,17?,20?/m1/s1