1-methyl-2-[2-(2-phenethylphenoxy)ethyl]pyrrolidin-1-ium chloride

Systemtic Name: 1-methyl-2-[2-(2-phenethylphenoxy)ethyl]pyrrolidin-1-ium chloride Openeye Name: 1-methyl-2-[2-(2-phenethylphenoxy)ethyl]pyrrolidin-1-ium chloride CAS Name: 1-methyl-2-[2-(2-phenethylphenoxy)ethyl]pyrrolidin-1-ium chloride IUPAC Name: 1-methyl-2-[2-(2-phenethylphenoxy)ethyl]pyrrolidin-1-ium chloride Traditional Name: 1-methyl-2-[2-(2-phenethylphenoxy)ethyl]pyrrolidin-1-ium chloride Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1CCOC2=CC=CC=C2CCC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C[NH+]1CCCC1CCOC2=CC=CC=C2CCC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C21H27NO.ClH/c1-22-16-7-11-20(22)15-17-23-21-12-6-5-10-19(21)14-13-18-8-3-2-4-9-18;/h2-6,8-10,12,20H,7,11,13-17H2,1H3;1H