1-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C17H23ClN5+ MolecularWeight: 332.85102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NN2CC[NH+](CC2)C)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N\N2CC[NH+](CC2)C)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C17H22ClN5/c1-14-16(12-19-22-10-8-21(2)9-11-22)17(18)23(20-14)13-15-6-4-3-5-7-15/h3-7,12H,8-11,13H2,1-2H3/p+1/b19-12-