(2S)-1,1,2-triphenyl-3-piperidin-1-ium-1-yl-propan-1-ol

Systemtic Name: (2S)-1,1,2-triphenyl-3-piperidin-1-ium-1-yl-propan-1-ol Openeye Name: (2S)-1,1,2-triphenyl-3-piperidin-1-ium-1-yl-propan-1-ol CAS Name: (2S)-1,1,2-triphenyl-3-(1-piperidin-1-iumyl)-1-propanol IUPAC Name: (2S)-1,1,2-triphenyl-3-piperidin-1-ium-1-ylpropan-1-ol Traditional Name: (2S)-1,1,2-triphenyl-3-piperidin-1-ium-1-yl-propan-1-ol Formula: C26H30NO+ MolecularWeight: 372.5225

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@H](C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C26H29NO/c28-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25(22-13-5-1-6-14-22)21-27-19-11-4-12-20-27/h1-3,5-10,13-18,25,28H,4,11-12,19-21H2/p+1/t25-/m1/s1