(2S)-2-(phenethyloxymethyl)pyrrolidin-1-ium

Systemtic Name: (2S)-2-(phenethyloxymethyl)pyrrolidin-1-ium Openeye Name: (2S)-2-(phenethyloxymethyl)pyrrolidin-1-ium CAS Name: (2S)-2-(phenethyloxymethyl)pyrrolidin-1-ium IUPAC Name: (2S)-2-(phenethyloxymethyl)pyrrolidin-1-ium Traditional Name: (2S)-2-(phenethyloxymethyl)pyrrolidin-1-ium Formula: C13H20NO+ MolecularWeight: 206.304

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)COCCC2=CC=CC=C2

Isomeric SMILES

C1C[C@H]([NH2+]C1)COCCC2=CC=CC=C2

InChI

InChI=1S/C13H19NO/c1-2-5-12(6-3-1)8-10-15-11-13-7-4-9-14-13/h1-3,5-6,13-14H,4,7-11H2/p+1/t13-/m0/s1