1-(4-methoxyphenyl)-2-(1,3,5-trimethyl-1,2,4-triazol-4-ium-4-yl)ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-(1,3,5-trimethyl-1,2,4-triazol-4-ium-4-yl)ethanone Openeye Name: 1-(4-methoxyphenyl)-2-(1,3,5-trimethyl-1,2,4-triazol-4-ium-4-yl)ethanone CAS Name: 1-(4-methoxyphenyl)-2-(1,3,5-trimethyl-1,2,4-triazol-4-ium-4-yl)ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-(1,3,5-trimethyl-1,2,4-triazol-4-ium-4-yl)ethanone Traditional Name: 1-(4-methoxyphenyl)-2-(1,3,5-trimethyl-1,2,4-triazol-4-ium-4-yl)ethanone Formula: C14H18N3O2+ MolecularWeight: 260.31162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=[N+]1CC(=O)C2=CC=C(C=C2)OC)C)C

Isomeric SMILES

CC1=NN(C(=[N+]1CC(=O)C2=CC=C(C=C2)OC)C)C

InChI

InChI=1S/C14H18N3O2/c1-10-15-16(3)11(2)17(10)9-14(18)12-5-7-13(19-4)8-6-12/h5-8H,9H2,1-4H3/q+1