(4-methoxyphenyl)-(1,1,3,5-tetramethylpyrazol-1-ium-4-yl)diazene ethanoate

Systemtic Name: (4-methoxyphenyl)-(1,1,3,5-tetramethylpyrazol-1-ium-4-yl)diazene ethanoate Openeye Name: (4-methoxyphenyl)-(1,1,3,5-tetramethylpyrazol-1-ium-4-yl)diazene acetate CAS Name: (4-methoxyphenyl)-(1,1,3,5-tetramethyl-4-pyrazol-1-iumyl)diazene acetate IUPAC Name: (4-methoxyphenyl)-(1,1,3,5-tetramethylpyrazol-1-ium-4-yl)diazene acetate Traditional Name: (4-methoxyphenyl)-(1,1,3,5-tetramethylpyrazol-1-ium-4-yl)diazene acetate Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=N[N+]1(C)C)C)N=NC2=CC=C(C=C2)OC.CC(=O)[O-]

Isomeric SMILES

CC1=C(C(=N[N+]1(C)C)C)N=NC2=CC=C(C=C2)OC.CC(=O)[O-]

InChI

InChI=1S/C14H19N4O.C2H4O2/c1-10-14(11(2)18(3,4)17-10)16-15-12-6-8-13(19-5)9-7-12;1-2(3)4/h6-9H,1-5H3;1H3,(H,3,4)/q+1;/p-1