N-[2-(3-methylphenyl)-3,4-dihydropyrazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: N-[2-(3-methylphenyl)-3,4-dihydropyrazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-N-[2-(m-tolyl)-3,4-dihydropyrazol-5-yl]methanimine CAS Name: N-[2-(3-methylphenyl)-3,4-dihydropyrazol-5-yl]-1-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: N-[2-(3-methylphenyl)-3,4-dihydropyrazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (4-methylpiperazin-4-ium-1-yl)methylene-[1-(m-tolyl)-2-pyrazolin-3-yl]amine Formula: C16H24N5+ MolecularWeight: 286.39526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCC(=N2)N=CN3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCC(=N2)N=CN3CC[NH+](CC3)C

InChI

InChI=1S/C16H23N5/c1-14-4-3-5-15(12-14)21-7-6-16(18-21)17-13-20-10-8-19(2)9-11-20/h3-5,12-13H,6-11H2,1-2H3/p+1