[1-(4-chlorophenyl)-5-methyl-3-propyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-(4-chlorophenyl)-5-methyl-3-propyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-(4-chlorophenyl)-5-methyl-3-propyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [1-(4-chlorophenyl)-5-methyl-3-propyl-4-pyrazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-(4-chlorophenyl)-5-methyl-3-propylpyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(4-chlorophenyl)-5-methyl-3-propyl-pyrazol-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C19H26ClN4O+ MolecularWeight: 361.88894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25ClN4O/c1-4-5-17-18(19(25)23-12-10-22(3)11-13-23)14(2)24(21-17)16-8-6-15(20)7-9-16/h6-9H,4-5,10-13H2,1-3H3/p+1