[(2S)-1-[4-(2,2-dimethylpropyl)phenoxy]-3-methyl-butan-2-yl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC1=CC=C(C=C1)CC(C)(C)C)[NH3+]

Isomeric SMILES

CC(C)[C@@H](COC1=CC=C(C=C1)CC(C)(C)C)[NH3+]

InChI

InChI=1S/C16H27NO/c1-12(2)15(17)11-18-14-8-6-13(7-9-14)10-16(3,4)5/h6-9,12,15H,10-11,17H2,1-5H3/p+1/t15-/m1/s1