[2-(4-chlorophenyl)-5-(furan-2-yl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2-(4-chlorophenyl)-5-(furan-2-yl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(4-chlorophenyl)-5-(2-furyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(4-chlorophenyl)-5-(2-furanyl)-3-pyrazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(4-chlorophenyl)-5-(furan-2-yl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [2-(4-chlorophenyl)-5-(2-furyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C20H22ClN4O2+ MolecularWeight: 385.86728

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=CO4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=CO4

InChI

InChI=1S/C20H21ClN4O2/c1-2-23-9-11-24(12-10-23)20(26)18-14-17(19-4-3-13-27-19)22-25(18)16-7-5-15(21)6-8-16/h3-8,13-14H,2,9-12H2,1H3/p+1