2-[[(2S)-1-(1-adamantyl)-1-oxidanylidene-propan-2-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(2S)-1-(1-adamantyl)-1-oxidanylidene-propan-2-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(1S)-2-(1-adamantyl)-1-methyl-2-oxo-ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2S)-1-(1-adamantyl)-1-oxopropan-2-yl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(2S)-1-(1-adamantyl)-1-oxopropan-2-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(1S)-2-(1-adamantyl)-2-keto-1-methyl-ethyl]amino]ethyl-dimethyl-ammonium Formula: C17H31N2O+ MolecularWeight: 279.44084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C12CC3CC(C1)CC(C3)C2)NCC[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)C12CC3CC(C1)CC(C3)C2)NCC[NH+](C)C

InChI

InChI=1S/C17H30N2O/c1-12(18-4-5-19(2)3)16(20)17-9-13-6-14(10-17)8-15(7-13)11-17/h12-15,18H,4-11H2,1-3H3/p+1/t12-,13?,14?,15?,17?/m0/s1