[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: [5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-chloro-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C18H23ClFN4O+ MolecularWeight: 365.852823

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C18H22ClFN4O/c1-3-8-22-9-11-23(12-10-22)18(25)16-13(2)21-24(17(16)19)15-6-4-14(20)5-7-15/h4-7H,3,8-12H2,1-2H3/p+1