1-[[(2S)-2-pyridin-2-ylaziridin-1-ium-1-yl]methyl]benzotriazole

Systemtic Name: 1-[[(2S)-2-pyridin-2-ylaziridin-1-ium-1-yl]methyl]benzotriazole Openeye Name: 1-[[(2S)-2-(2-pyridyl)aziridin-1-ium-1-yl]methyl]benzotriazole CAS Name: 1-[[(2S)-2-(2-pyridinyl)-1-aziridin-1-iumyl]methyl]benzotriazole IUPAC Name: 1-[[(2S)-2-pyridin-2-ylaziridin-1-ium-1-yl]methyl]benzotriazole Traditional Name: 1-[[(2S)-2-(2-pyridyl)ethylenimin-1-ium-1-yl]methyl]benzotriazole Formula: C14H14N5+ MolecularWeight: 252.29446

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH+]1CN2C3=CC=CC=C3N=N2)C4=CC=CC=N4

Isomeric SMILES

C1[C@H]([NH+]1CN2C3=CC=CC=C3N=N2)C4=CC=CC=N4

InChI

InChI=1S/C14H13N5/c1-2-7-13-12(6-1)16-17-19(13)10-18-9-14(18)11-5-3-4-8-15-11/h1-8,14H,9-10H2/p+1/t14-,18?/m0/s1