(2S)-2-phenyl-2-[(2S,5S)-2-phenyl-5-prop-2-enyl-pyrrolidin-1-ium-1-yl]ethanol

Systemtic Name: (2S)-2-phenyl-2-[(2S,5S)-2-phenyl-5-prop-2-enyl-pyrrolidin-1-ium-1-yl]ethanol Openeye Name: (2S)-2-[(2S,5S)-2-allyl-5-phenyl-pyrrolidin-1-ium-1-yl]-2-phenyl-ethanol CAS Name: (2S)-2-phenyl-2-[(2S,5S)-2-phenyl-5-prop-2-enyl-1-pyrrolidin-1-iumyl]ethanol IUPAC Name: (2S)-2-phenyl-2-[(2S,5S)-2-phenyl-5-prop-2-enylpyrrolidin-1-ium-1-yl]ethanol Traditional Name: (2S)-2-[(2S,5S)-2-allyl-5-phenyl-pyrrolidin-1-ium-1-yl]-2-phenyl-ethanol Formula: C21H26NO+ MolecularWeight: 308.43724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1CCC([NH+]1C(CO)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C=CC[C@@H]1CC[C@H]([NH+]1[C@H](CO)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO/c1-2-9-19-14-15-20(17-10-5-3-6-11-17)22(19)21(16-23)18-12-7-4-8-13-18/h2-8,10-13,19-21,23H,1,9,14-16H2/p+1/t19-,20+,21-/m1/s1