[(2S,3R,5S)-5-(hydroxymethyl)-1,5-dimethyl-2-phenyl-pyrrolidin-1-ium-3-yl]methylazanium

Systemtic Name: [(2S,3R,5S)-5-(hydroxymethyl)-1,5-dimethyl-2-phenyl-pyrrolidin-1-ium-3-yl]methylazanium Openeye Name: [(2S,3R,5S)-5-(hydroxymethyl)-1,5-dimethyl-2-phenyl-pyrrolidin-1-ium-3-yl]methylammonium CAS Name: [(2S,3R,5S)-5-(hydroxymethyl)-1,5-dimethyl-2-phenyl-3-pyrrolidin-1-iumyl]methylammonium IUPAC Name: [(2S,3R,5S)-5-(hydroxymethyl)-1,5-dimethyl-2-phenylpyrrolidin-1-ium-3-yl]methylazanium Traditional Name: [(2S,3R,5S)-1,5-dimethyl-5-methylol-2-phenyl-pyrrolidin-1-ium-3-yl]methylammonium Formula: C14H24N2O+2 MolecularWeight: 236.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C([NH+]1C)C2=CC=CC=C2)C[NH3+])CO

Isomeric SMILES

C[C@]1(C[C@@H]([C@H]([NH+]1C)C2=CC=CC=C2)C[NH3+])CO

InChI

InChI=1S/C14H22N2O/c1-14(10-17)8-12(9-15)13(16(14)2)11-6-4-3-5-7-11/h3-7,12-13,17H,8-10,15H2,1-2H3/p+2/t12-,13-,14+/m1/s1