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

Systemtic Name: [1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [1-(4-methoxyphenyl)-5-methyl-4-pyrazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H22N4O2/c1-13-16(17(22)20-10-8-19(2)9-11-20)12-18-21(13)14-4-6-15(23-3)7-5-14/h4-7,12H,8-11H2,1-3H3/p+1