(5-ethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-ethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-ethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (5-ethyl-1-phenyl-4-pyrazolyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-ethyl-1-phenylpyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-ethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H22N4O/c1-3-16-15(17(22)20-11-9-19(2)10-12-20)13-18-21(16)14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3/p+1