[(2S,3S)-2-[4-(2-methylbutan-2-yl)phenoxy]pentan-3-yl]azanium

Systemtic Name: [(2S,3S)-2-[4-(2-methylbutan-2-yl)phenoxy]pentan-3-yl]azanium Openeye Name: [(1S,2S)-2-[4-(1,1-dimethylpropyl)phenoxy]-1-ethyl-propyl]ammonium CAS Name: [(2S,3S)-2-[4-(2-methylbutan-2-yl)phenoxy]pentan-3-yl]ammonium IUPAC Name: [(2S,3S)-2-[4-(2-methylbutan-2-yl)phenoxy]pentan-3-yl]azanium Traditional Name: [(1S,2S)-2-(4-tert-amylphenoxy)-1-ethyl-propyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)OC1=CC=C(C=C1)C(C)(C)CC)[NH3+]

Isomeric SMILES

CC[C@@H]([C@H](C)OC1=CC=C(C=C1)C(C)(C)CC)[NH3+]

InChI

InChI=1S/C16H27NO/c1-6-15(17)12(3)18-14-10-8-13(9-11-14)16(4,5)7-2/h8-12,15H,6-7,17H2,1-5H3/p+1/t12-,15-/m0/s1