[(2S)-3-(1-ethynylcyclohexyl)oxy-2-oxidanyl-propyl]-(2,4,4-trimethylpentan-2-yl)azanium

Systemtic Name: [(2S)-3-(1-ethynylcyclohexyl)oxy-2-oxidanyl-propyl]-(2,4,4-trimethylpentan-2-yl)azanium Openeye Name: [(2S)-3-(1-ethynylcyclohexoxy)-2-hydroxy-propyl]-(1,1,3,3-tetramethylbutyl)ammonium CAS Name: [(2S)-3-(1-ethynylcyclohexyl)oxy-2-hydroxypropyl]-(2,4,4-trimethylpentan-2-yl)ammonium IUPAC Name: [(2S)-3-(1-ethynylcyclohexyl)oxy-2-hydroxypropyl]-(2,4,4-trimethylpentan-2-yl)azanium Traditional Name: [(2S)-3-(1-ethynylcyclohexoxy)-2-hydroxy-propyl]-(1,1,3,3-tetramethylbutyl)ammonium Formula: C19H36NO2+ MolecularWeight: 310.49464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)[NH2+]CC(COC1(CCCCC1)C#C)O

Isomeric SMILES

CC(C)(C)CC(C)(C)[NH2+]C[C@@H](COC1(CCCCC1)C#C)O

InChI

InChI=1S/C19H35NO2/c1-7-19(11-9-8-10-12-19)22-14-16(21)13-20-18(5,6)15-17(2,3)4/h1,16,20-21H,8-15H2,2-6H3/p+1/t16-/m0/s1