(1-methylpyrazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (1-methylpyrazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (1-methylpyrazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (1-methyl-4-pyrazolyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (1-methylpyrazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (1-methylpyrazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C=N1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C17H22N4O/c1-19-14-16(13-18-19)17(22)21-11-9-20(10-12-21)8-7-15-5-3-2-4-6-15/h2-6,13-14H,7-12H2,1H3/p+1