(3,5-diethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3,5-diethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (3,5-diethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (3,5-diethyl-1-phenyl-4-pyrazolyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3,5-diethyl-1-phenylpyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (3,5-diethyl-1-phenyl-pyrazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C19H27N4O+ MolecularWeight: 327.44388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4O/c1-4-16-18(19(24)22-13-11-21(3)12-14-22)17(5-2)23(20-16)15-9-7-6-8-10-15/h6-10H,4-5,11-14H2,1-3H3/p+1