(1R,2S)-1-(4-ethylphenyl)-1-(2-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol

Systemtic Name: (1R,2S)-1-(4-ethylphenyl)-1-(2-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol Openeye Name: (1R,2S)-1-(4-ethylphenyl)-1-(2-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol CAS Name: (1R,2S)-1-(4-ethylphenyl)-1-(2-methoxyphenyl)-2-phenyl-3-(1-pyrrolidin-1-iumyl)-1-propanol IUPAC Name: (1R,2S)-1-(4-ethylphenyl)-1-(2-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-ylpropan-1-ol Traditional Name: (1R,2S)-1-(4-ethylphenyl)-1-(2-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol Formula: C28H34NO2+ MolecularWeight: 416.57506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CC=C2OC)(C(C[NH+]3CCCC3)C4=CC=CC=C4)O

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@](C2=CC=CC=C2OC)([C@H](C[NH+]3CCCC3)C4=CC=CC=C4)O

InChI

InChI=1S/C28H33NO2/c1-3-22-15-17-24(18-16-22)28(30,25-13-7-8-14-27(25)31-2)26(21-29-19-9-10-20-29)23-11-5-4-6-12-23/h4-8,11-18,26,30H,3,9-10,19-21H2,1-2H3/p+1/t26-,28-/m1/s1