(1S,2S,3S)-1-methyl-3-phenyl-1-(phenylmethyl)azetidin-1-ium-2-carbonitrile

Systemtic Name: (1S,2S,3S)-1-methyl-3-phenyl-1-(phenylmethyl)azetidin-1-ium-2-carbonitrile Openeye Name: (1S,2S,3S)-1-benzyl-1-methyl-3-phenyl-azetidin-1-ium-2-carbonitrile CAS Name: (1S,2S,3S)-1-methyl-3-phenyl-1-(phenylmethyl)-2-azetidin-1-iumcarbonitrile IUPAC Name: (1S,2S,3S)-1-benzyl-1-methyl-3-phenylazetidin-1-ium-2-carbonitrile Traditional Name: (1S,2S,3S)-1-benzyl-1-methyl-3-phenyl-azetidin-1-ium-2-carbonitrile Formula: C18H19N2+ MolecularWeight: 263.35686

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC(C1C#N)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C[N@+]1(C[C@@H]([C@H]1C#N)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H19N2/c1-20(13-15-8-4-2-5-9-15)14-17(18(20)12-19)16-10-6-3-7-11-16/h2-11,17-18H,13-14H2,1H3/q+1/t17-,18-,20-/m1/s1