[1-(3,4-dichlorophenyl)-5-ethyl-3-propyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-propyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-propyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-propyl-4-pyrazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-propylpyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(3,4-dichlorophenyl)-5-ethyl-3-propyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C21H29Cl2N4O+ MolecularWeight: 424.38716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C(=O)N2CC[NH+](CC2)CC)CC)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCC1=NN(C(=C1C(=O)N2CC[NH+](CC2)CC)CC)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H28Cl2N4O/c1-4-7-18-20(21(28)26-12-10-25(6-3)11-13-26)19(5-2)27(24-18)15-8-9-16(22)17(23)14-15/h8-9,14H,4-7,10-13H2,1-3H3/p+1