[3-(4-methylphenyl)-1H-pyrazol-5-yl]-piperazin-4-ium-1-yl-methanone

Systemtic Name: [3-(4-methylphenyl)-1H-pyrazol-5-yl]-piperazin-4-ium-1-yl-methanone Openeye Name: piperazin-4-ium-1-yl-[3-(p-tolyl)-1H-pyrazol-5-yl]methanone CAS Name: [3-(4-methylphenyl)-1H-pyrazol-5-yl]-(1-piperazin-4-iumyl)methanone IUPAC Name: [3-(4-methylphenyl)-1H-pyrazol-5-yl]-piperazin-4-ium-1-ylmethanone Traditional Name: piperazin-4-ium-1-yl-[3-(p-tolyl)-1H-pyrazol-5-yl]methanone Formula: C15H19N4O+ MolecularWeight: 271.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C15H18N4O/c1-11-2-4-12(5-3-11)13-10-14(18-17-13)15(20)19-8-6-16-7-9-19/h2-5,10,16H,6-9H2,1H3,(H,17,18)/p+1