1-[6-(2,3,5-trimethylphenoxy)hexyl]pyrrolidin-1-ium

Systemtic Name: 1-[6-(2,3,5-trimethylphenoxy)hexyl]pyrrolidin-1-ium Openeye Name: 1-[6-(2,3,5-trimethylphenoxy)hexyl]pyrrolidin-1-ium CAS Name: 1-[6-(2,3,5-trimethylphenoxy)hexyl]pyrrolidin-1-ium IUPAC Name: 1-[6-(2,3,5-trimethylphenoxy)hexyl]pyrrolidin-1-ium Traditional Name: 1-[6-(2,3,5-trimethylphenoxy)hexyl]pyrrolidin-1-ium Formula: C19H32NO+ MolecularWeight: 290.46348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31NO/c1-16-14-17(2)18(3)19(15-16)21-13-9-5-4-6-10-20-11-7-8-12-20/h14-15H,4-13H2,1-3H3/p+1