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

Systemtic Name: [1-methyl-5-(4-methylphenyl)pyrazol-3-yl]-piperazin-4-ium-1-yl-methanone Openeye Name: [1-methyl-5-(p-tolyl)pyrazol-3-yl]-piperazin-4-ium-1-yl-methanone CAS Name: [1-methyl-5-(4-methylphenyl)-3-pyrazolyl]-(1-piperazin-4-iumyl)methanone IUPAC Name: [1-methyl-5-(4-methylphenyl)pyrazol-3-yl]-piperazin-4-ium-1-ylmethanone Traditional Name: [1-methyl-5-(p-tolyl)pyrazol-3-yl]-piperazin-4-ium-1-yl-methanone Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C16H20N4O/c1-12-3-5-13(6-4-12)15-11-14(18-19(15)2)16(21)20-9-7-17-8-10-20/h3-6,11,17H,7-10H2,1-2H3/p+1