(4-ethylpiperazin-4-ium-1-yl)-(1-phenylpyrazol-4-yl)methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-(1-phenylpyrazol-4-yl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(1-phenylpyrazol-4-yl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-(1-phenyl-4-pyrazolyl)methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-(1-phenylpyrazol-4-yl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(1-phenylpyrazol-4-yl)methanone Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O/c1-2-18-8-10-19(11-9-18)16(21)14-12-17-20(13-14)15-6-4-3-5-7-15/h3-7,12-13H,2,8-11H2,1H3/p+1