[1-(3-chlorophenyl)-3-cyclopropyl-5-methyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2C3CC3)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2C3CC3)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C20H25ClN4O/c1-3-23-9-11-24(12-10-23)20(26)18-14(2)25(22-19(18)15-7-8-15)17-6-4-5-16(21)13-17/h4-6,13,15H,3,7-12H2,1-2H3/p+1