(2S,3S)-2,3-diphenyl-4-piperidin-1-ium-1-yl-butan-2-ol

Systemtic Name: (2S,3S)-2,3-diphenyl-4-piperidin-1-ium-1-yl-butan-2-ol Openeye Name: (2S,3S)-2,3-diphenyl-4-piperidin-1-ium-1-yl-butan-2-ol CAS Name: (2S,3S)-2,3-diphenyl-4-(1-piperidin-1-iumyl)-2-butanol IUPAC Name: (2S,3S)-2,3-diphenyl-4-piperidin-1-ium-1-ylbutan-2-ol Traditional Name: (2S,3S)-2,3-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO/c1-21(23,19-13-7-3-8-14-19)20(18-11-5-2-6-12-18)17-22-15-9-4-10-16-22/h2-3,5-8,11-14,20,23H,4,9-10,15-17H2,1H3/p+1/t20-,21-/m1/s1