4-methyl-3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-amine chloride

Systemtic Name: 4-methyl-3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-amine chloride Openeye Name: 4-methyl-3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-amine chloride CAS Name: 4-methyl-3-(1-phenylpropan-2-yl)-5-oxadiazol-3-iumamine chloride IUPAC Name: 4-methyl-3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-amine chloride Traditional Name: [4-methyl-3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]amine chloride Formula: C12H16ClN3O MolecularWeight: 253.72794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=[N+]1C(C)CC2=CC=CC=C2)N.[Cl-]

Isomeric SMILES

CC1=C(ON=[N+]1C(C)CC2=CC=CC=C2)N.[Cl-]

InChI

InChI=1S/C12H16N3O.ClH/c1-9(8-11-6-4-3-5-7-11)15-10(2)12(13)16-14-15;/h3-7,9H,8,13H2,1-2H3;1H/q+1;/p-1