1-(4-methylphenyl)-2-(1H-pyrazol-2-ium-2-yl)-2-pyrazol-1-yl-ethanone

Systemtic Name: 1-(4-methylphenyl)-2-(1H-pyrazol-2-ium-2-yl)-2-pyrazol-1-yl-ethanone Openeye Name: 1-(p-tolyl)-2-(1H-pyrazol-2-ium-2-yl)-2-pyrazol-1-yl-ethanone CAS Name: 1-(4-methylphenyl)-2-(1H-pyrazol-2-ium-2-yl)-2-(1-pyrazolyl)ethanone IUPAC Name: 1-(4-methylphenyl)-2-(1H-pyrazol-2-ium-2-yl)-2-pyrazol-1-ylethanone Traditional Name: 1-(p-tolyl)-2-(1H-pyrazol-2-ium-2-yl)-2-pyrazol-1-yl-ethanone Formula: C15H15N4O+ MolecularWeight: 267.3058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(N2C=CC=N2)[N+]3=CC=CN3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(N2C=CC=N2)[N+]3=CC=CN3

InChI

InChI=1S/C15H14N4O/c1-12-4-6-13(7-5-12)14(20)15(18-10-2-8-16-18)19-11-3-9-17-19/h2-11,15H,1H3/p+1