(1-ethylpyrazol-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (1-ethylpyrazol-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (1-ethylpyrazol-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (1-ethyl-3-pyrazolyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (1-ethylpyrazol-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (1-ethylpyrazol-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C18H25N4O+ MolecularWeight: 313.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

CCN1C=CC(=N1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C18H24N4O/c1-2-22-11-9-17(19-22)18(23)21-14-12-20(13-15-21)10-8-16-6-4-3-5-7-16/h3-7,9,11H,2,8,10,12-15H2,1H3/p+1