2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoyloxy]ethyl-trimethyl-azanium

Systemtic Name: 2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoyloxy]ethyl-trimethyl-azanium Openeye Name: 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoyloxy]ethyl-trimethyl-ammonium CAS Name: 2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxopropoxy]ethyl-trimethylammonium IUPAC Name: 2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]ethyl-trimethylazanium Traditional Name: 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoyloxy]ethyl-trimethyl-ammonium Formula: C22H38NO3+ MolecularWeight: 364.54202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCC[N+](C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCC[N+](C)(C)C

InChI

InChI=1S/C22H37NO3/c1-21(2,3)17-14-16(15-18(20(17)25)22(4,5)6)10-11-19(24)26-13-12-23(7,8)9/h14-15H,10-13H2,1-9H3/p+1