1-[2-(4-tert-butyl-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium

Systemtic Name: 1-[2-(4-tert-butyl-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium Openeye Name: 1-[2-(4-tert-butyl-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium CAS Name: 1-[2-(4-tert-butyl-2-methylphenoxy)ethyl]pyrrolidin-1-ium IUPAC Name: 1-[2-(4-tert-butyl-2-methylphenoxy)ethyl]pyrrolidin-1-ium Traditional Name: 1-[2-(4-tert-butyl-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OCC[NH+]2CCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OCC[NH+]2CCCC2

InChI

InChI=1S/C17H27NO/c1-14-13-15(17(2,3)4)7-8-16(14)19-12-11-18-9-5-6-10-18/h7-8,13H,5-6,9-12H2,1-4H3/p+1