[(2S)-3-(1-ethynylcyclohexyl)oxy-2-oxidanyl-propyl]-dimethyl-azanium

Systemtic Name: [(2S)-3-(1-ethynylcyclohexyl)oxy-2-oxidanyl-propyl]-dimethyl-azanium Openeye Name: [(2S)-3-(1-ethynylcyclohexoxy)-2-hydroxy-propyl]-dimethyl-ammonium CAS Name: [(2S)-3-(1-ethynylcyclohexyl)oxy-2-hydroxypropyl]-dimethylammonium IUPAC Name: [(2S)-3-(1-ethynylcyclohexyl)oxy-2-hydroxypropyl]-dimethylazanium Traditional Name: [(2S)-3-(1-ethynylcyclohexoxy)-2-hydroxy-propyl]-dimethyl-ammonium Formula: C13H24NO2+ MolecularWeight: 226.33516

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(COC1(CCCCC1)C#C)O

Isomeric SMILES

C[NH+](C)C[C@@H](COC1(CCCCC1)C#C)O

InChI

InChI=1S/C13H23NO2/c1-4-13(8-6-5-7-9-13)16-11-12(15)10-14(2)3/h1,12,15H,5-11H2,2-3H3/p+1/t12-/m0/s1