N,N-dimethyl-2-[4-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[[5-(1-naphthalenyl)-1H-pyrazol-4-yl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]acetamide Formula: C22H28N5O+ MolecularWeight: 378.49062

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)CC2=C(NN=C2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)CC2=C(NN=C2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H27N5O/c1-25(2)21(28)16-27-12-10-26(11-13-27)15-18-14-23-24-22(18)20-9-5-7-17-6-3-4-8-19(17)20/h3-9,14H,10-13,15-16H2,1-2H3,(H,23,24)/p+1