(2S,3S)-3-butyl-1,1,2-tris(phenylmethyl)azetidin-1-ium-3-ol

Systemtic Name: (2S,3S)-3-butyl-1,1,2-tris(phenylmethyl)azetidin-1-ium-3-ol Openeye Name: (2S,3S)-1,1,2-tribenzyl-3-butyl-azetidin-1-ium-3-ol CAS Name: (2S,3S)-3-butyl-1,1,2-tris(phenylmethyl)-3-azetidin-1-iumol IUPAC Name: (2S,3S)-1,1,2-tribenzyl-3-butylazetidin-1-ium-3-ol Traditional Name: (2S,3S)-1,1,2-tribenzyl-3-butyl-azetidin-1-ium-3-ol Formula: C28H34NO+ MolecularWeight: 400.57566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C[N+](C1CC2=CC=CC=C2)(CC3=CC=CC=C3)CC4=CC=CC=C4)O

Isomeric SMILES

CCCC[C@@]1(C[N+]([C@H]1CC2=CC=CC=C2)(CC3=CC=CC=C3)CC4=CC=CC=C4)O

InChI

InChI=1S/C28H34NO/c1-2-3-19-28(30)23-29(21-25-15-9-5-10-16-25,22-26-17-11-6-12-18-26)27(28)20-24-13-7-4-8-14-24/h4-18,27,30H,2-3,19-23H2,1H3/q+1/t27-,28-/m0/s1