(2S)-1,2-diphenyl-4-piperidin-1-ium-1-yl-butan-2-ol

Systemtic Name: (2S)-1,2-diphenyl-4-piperidin-1-ium-1-yl-butan-2-ol Openeye Name: (2S)-1,2-diphenyl-4-piperidin-1-ium-1-yl-butan-2-ol CAS Name: (2S)-1,2-diphenyl-4-(1-piperidin-1-iumyl)-2-butanol IUPAC Name: (2S)-1,2-diphenyl-4-piperidin-1-ium-1-ylbutan-2-ol Traditional Name: (2S)-1,2-diphenyl-4-piperidin-1-ium-1-yl-butan-2-ol Formula: C21H28NO+ MolecularWeight: 310.45312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(CC2=CC=CC=C2)(C3=CC=CC=C3)O

Isomeric SMILES

C1CC[NH+](CC1)CC[C@@](CC2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C21H27NO/c23-21(20-12-6-2-7-13-20,18-19-10-4-1-5-11-19)14-17-22-15-8-3-9-16-22/h1-2,4-7,10-13,23H,3,8-9,14-18H2/p+1/t21-/m1/s1