[(1R,2S)-2-(2,3,5-trimethylphenoxy)cyclooctyl]azanium

Systemtic Name: [(1R,2S)-2-(2,3,5-trimethylphenoxy)cyclooctyl]azanium Openeye Name: [(1R,2S)-2-(2,3,5-trimethylphenoxy)cyclooctyl]ammonium CAS Name: [(1R,2S)-2-(2,3,5-trimethylphenoxy)cyclooctyl]ammonium IUPAC Name: [(1R,2S)-2-(2,3,5-trimethylphenoxy)cyclooctyl]azanium Traditional Name: [(1R,2S)-2-(2,3,5-trimethylphenoxy)cyclooctyl]ammonium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2CCCCCCC2[NH3+])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)O[C@H]2CCCCCC[C@H]2[NH3+])C)C

InChI

InChI=1S/C17H27NO/c1-12-10-13(2)14(3)17(11-12)19-16-9-7-5-4-6-8-15(16)18/h10-11,15-16H,4-9,18H2,1-3H3/p+1/t15-,16+/m1/s1