(5-methyl-1-phenyl-3-propyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-methyl-1-phenyl-3-propyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-methyl-1-phenyl-3-propyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (5-methyl-1-phenyl-3-propyl-4-pyrazolyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-methyl-1-phenyl-3-propylpyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-methyl-1-phenyl-3-propyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C19H27N4O+ MolecularWeight: 327.44388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4O/c1-4-8-17-18(19(24)22-13-11-21(3)12-14-22)15(2)23(20-17)16-9-6-5-7-10-16/h5-7,9-10H,4,8,11-14H2,1-3H3/p+1