(2S,3S,4S)-2-ethenyl-4-octoxy-1-(phenylmethyl)pyrrolidin-3-ol

Systemtic Name: (2S,3S,4S)-2-ethenyl-4-octoxy-1-(phenylmethyl)pyrrolidin-3-ol Openeye Name: (2S,3S,4S)-1-benzyl-4-octoxy-2-vinyl-pyrrolidin-3-ol CAS Name: (2S,3S,4S)-2-ethenyl-4-octoxy-1-(phenylmethyl)-3-pyrrolidinol IUPAC Name: (2S,3S,4S)-1-benzyl-2-ethenyl-4-octoxypyrrolidin-3-ol Traditional Name: (2S,3S,4S)-1-benzyl-4-octoxy-2-vinyl-pyrrolidin-3-ol Formula: C21H33NO2 MolecularWeight: 331.49222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1CN(C(C1O)C=C)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCO[C@H]1CN([C@H]([C@@H]1O)C=C)CC2=CC=CC=C2

InChI

InChI=1S/C21H33NO2/c1-3-5-6-7-8-12-15-24-20-17-22(19(4-2)21(20)23)16-18-13-10-9-11-14-18/h4,9-11,13-14,19-21,23H,2-3,5-8,12,15-17H2,1H3/t19-,20-,21-/m0/s1