(4-methoxyphenyl)-[(2S,3R)-1-methyl-3-phenyl-aziridin-1-ium-2-yl]methanone

Systemtic Name: (4-methoxyphenyl)-[(2S,3R)-1-methyl-3-phenyl-aziridin-1-ium-2-yl]methanone Openeye Name: (4-methoxyphenyl)-[(2S,3R)-1-methyl-3-phenyl-aziridin-1-ium-2-yl]methanone CAS Name: (4-methoxyphenyl)-[(2S,3R)-1-methyl-3-phenyl-2-aziridin-1-iumyl]methanone IUPAC Name: (4-methoxyphenyl)-[(2S,3R)-1-methyl-3-phenylaziridin-1-ium-2-yl]methanone Traditional Name: (4-methoxyphenyl)-[(2S,3R)-1-methyl-3-phenyl-ethylenimin-1-ium-2-yl]methanone Formula: C17H18NO2+ MolecularWeight: 268.33032

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C(C1C(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1[C@@H]([C@H]1C(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C17H17NO2/c1-18-15(12-6-4-3-5-7-12)16(18)17(19)13-8-10-14(20-2)11-9-13/h3-11,15-16H,1-2H3/p+1/t15-,16+,18?/m1/s1