2-[(2S)-1-cyclohexylaziridin-1-ium-2-yl]benzotriazole

Systemtic Name: 2-[(2S)-1-cyclohexylaziridin-1-ium-2-yl]benzotriazole Openeye Name: 2-[(2S)-1-cyclohexylaziridin-1-ium-2-yl]benzotriazole CAS Name: 2-[(2S)-1-cyclohexyl-2-aziridin-1-iumyl]benzotriazole IUPAC Name: 2-[(2S)-1-cyclohexylaziridin-1-ium-2-yl]benzotriazole Traditional Name: 2-[(2S)-1-cyclohexylethylenimin-1-ium-2-yl]benzotriazole Formula: C14H19N4+ MolecularWeight: 243.32746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CC2N3N=C4C=CC=CC4=N3

Isomeric SMILES

C1CCC(CC1)[NH+]2C[C@@H]2N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C14H18N4/c1-2-6-11(7-3-1)17-10-14(17)18-15-12-8-4-5-9-13(12)16-18/h4-5,8-9,11,14H,1-3,6-7,10H2/p+1/t14-,17?/m0/s1