[(2S)-1-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]ammonium CAS Name: [(2S)-1-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propan-2-yl]azanium Traditional Name: [(1S)-1-methyl-2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO/c1-13(18)11-19-15-9-7-14(8-10-15)17(5,6)12-16(2,3)4/h7-10,13H,11-12,18H2,1-6H3/p+1/t13-/m0/s1