(2S)-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-ium-1-yl]-2-phenyl-ethanol

Systemtic Name: (2S)-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-ium-1-yl]-2-phenyl-ethanol Openeye Name: (2S)-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-ium-1-yl]-2-phenyl-ethanol CAS Name: (2S)-2-[(2R,5S)-2,5-dimethyl-1-pyrrolidin-1-iumyl]-2-phenylethanol IUPAC Name: (2S)-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-ium-1-yl]-2-phenylethanol Traditional Name: (2S)-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-ium-1-yl]-2-phenyl-ethanol Formula: C14H22NO+ MolecularWeight: 220.33058

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC([NH+]1C(CO)C2=CC=CC=C2)C

Isomeric SMILES

C[C@@H]1CC[C@@H]([NH+]1[C@H](CO)C2=CC=CC=C2)C

InChI

InChI=1S/C14H21NO/c1-11-8-9-12(2)15(11)14(10-16)13-6-4-3-5-7-13/h3-7,11-12,14,16H,8-10H2,1-2H3/p+1/t11-,12+,14-/m1/s1