[1-(4-chlorophenyl)-3-cyclopropyl-5-ethyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-(4-chlorophenyl)-3-cyclopropyl-5-ethyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-(4-chlorophenyl)-3-cyclopropyl-5-ethyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [1-(4-chlorophenyl)-3-cyclopropyl-5-ethyl-4-pyrazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-(4-chlorophenyl)-3-cyclopropyl-5-ethylpyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(4-chlorophenyl)-3-cyclopropyl-5-ethyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C20H26ClN4O+ MolecularWeight: 373.89964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=C(C=C2)Cl)C3CC3)C(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=C(C=C2)Cl)C3CC3)C(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C20H25ClN4O/c1-3-17-18(20(26)24-12-10-23(2)11-13-24)19(14-4-5-14)22-25(17)16-8-6-15(21)7-9-16/h6-9,14H,3-5,10-13H2,1-2H3/p+1