(1S,2S)-1-[4-(2-methylpropoxy)phenyl]-2-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol

Systemtic Name: (1S,2S)-1-[4-(2-methylpropoxy)phenyl]-2-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol Openeye Name: (1S,2S)-1-(4-isobutoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol CAS Name: (1S,2S)-1-[4-(2-methylpropoxy)phenyl]-2-phenyl-3-(1-piperidin-1-iumyl)-1-propanol IUPAC Name: (1S,2S)-1-[4-(2-methylpropoxy)phenyl]-2-phenyl-3-piperidin-1-ium-1-ylpropan-1-ol Traditional Name: (1S,2S)-1-(4-isobutoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol Formula: C24H34NO2+ MolecularWeight: 368.53226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(C(C[NH+]2CCCCC2)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)[C@H]([C@H](C[NH+]2CCCCC2)C3=CC=CC=C3)O

InChI

InChI=1S/C24H33NO2/c1-19(2)18-27-22-13-11-21(12-14-22)24(26)23(20-9-5-3-6-10-20)17-25-15-7-4-8-16-25/h3,5-6,9-14,19,23-24,26H,4,7-8,15-18H2,1-2H3/p+1/t23-,24-/m1/s1