(5-ethyl-1-methyl-3-propyl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-ethyl-1-methyl-3-propyl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-ethyl-1-methyl-3-propyl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: (5-ethyl-1-methyl-3-propyl-4-pyrazolyl)-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-ethyl-1-methyl-3-propylpyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-ethyl-1-methyl-3-propyl-pyrazol-4-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C16H29N4O+ MolecularWeight: 293.42766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N4O/c1-5-8-13-15(14(6-2)18(4)17-13)16(21)20-11-9-19(7-3)10-12-20/h5-12H2,1-4H3/p+1