[1-(2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoyl)oxy-3-ethyl-pentan-3-yl]azanium

Systemtic Name: [1-(2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoyl)oxy-3-ethyl-pentan-3-yl]azanium Openeye Name: [3-(2-cyclohexyl-2-hydroxy-2-phenyl-acetyl)oxy-1,1-diethyl-propyl]ammonium CAS Name: [1-(2-cyclohexyl-2-hydroxy-1-oxo-2-phenylethoxy)-3-ethylpentan-3-yl]ammonium IUPAC Name: [1-(2-cyclohexyl-2-hydroxy-2-phenylacetyl)oxy-3-ethylpentan-3-yl]azanium Traditional Name: [3-(2-cyclohexyl-2-hydroxy-2-phenyl-acetyl)oxy-1,1-diethyl-propyl]ammonium Formula: C21H34NO3+ MolecularWeight: 348.49956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O)[NH3+]

Isomeric SMILES

CCC(CC)(CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O)[NH3+]

InChI

InChI=1S/C21H33NO3/c1-3-20(22,4-2)15-16-25-19(23)21(24,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5,7-8,11-12,18,24H,3-4,6,9-10,13-16,22H2,1-2H3/p+1