[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-methyl-1-(2-methylphenyl)pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-methyl-1-(o-tolyl)pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [5-methyl-1-(2-methylphenyl)-4-pyrazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-methyl-1-(2-methylphenyl)pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-methyl-1-(o-tolyl)pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C17H22N4O/c1-13-6-4-5-7-16(13)21-14(2)15(12-18-21)17(22)20-10-8-19(3)9-11-20/h4-7,12H,8-11H2,1-3H3/p+1