(1S,2S)-1-(4-pentoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol

Systemtic Name: (1S,2S)-1-(4-pentoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol Openeye Name: (1S,2S)-1-(4-pentoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol CAS Name: (1S,2S)-1-(4-pentoxyphenyl)-2-phenyl-3-(1-pyrrolidin-1-iumyl)-1-propanol IUPAC Name: (1S,2S)-1-(4-pentoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-ylpropan-1-ol Traditional Name: (1S,2S)-1-(4-amoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-ol Formula: C24H34NO2+ MolecularWeight: 368.53226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(C(C[NH+]2CCCC2)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)[C@H]([C@H](C[NH+]2CCCC2)C3=CC=CC=C3)O

InChI

InChI=1S/C24H33NO2/c1-2-3-9-18-27-22-14-12-21(13-15-22)24(26)23(19-25-16-7-8-17-25)20-10-5-4-6-11-20/h4-6,10-15,23-24,26H,2-3,7-9,16-19H2,1H3/p+1/t23-,24-/m1/s1