trimethyl-[2-oxidanyl-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]azanium

Systemtic Name: trimethyl-[2-oxidanyl-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]azanium Openeye Name: [2-hydroxy-3-[4-(1,1,3,3-tetramethylbutyl)phenoxy]propyl]-trimethyl-ammonium CAS Name: [2-hydroxy-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]-trimethylammonium IUPAC Name: [2-hydroxy-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]-trimethylazanium Traditional Name: [2-hydroxy-3-[4-(1,1,3,3-tetramethylbutyl)phenoxy]propyl]-trimethyl-ammonium Formula: C20H36NO2+ MolecularWeight: 322.50534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC(C[N+](C)(C)C)O

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC(C[N+](C)(C)C)O

InChI

InChI=1S/C20H36NO2/c1-19(2,3)15-20(4,5)16-9-11-18(12-10-16)23-14-17(22)13-21(6,7)8/h9-12,17,22H,13-15H2,1-8H3/q+1