2-(3-methylphenyl)-N-(piperidin-1-ium-1-ylidenemethyl)-3,4-dihydropyrazol-5-amine

Systemtic Name: 2-(3-methylphenyl)-N-(piperidin-1-ium-1-ylidenemethyl)-3,4-dihydropyrazol-5-amine Openeye Name: 2-(m-tolyl)-N-(piperidin-1-ium-1-ylidenemethyl)-3,4-dihydropyrazol-5-amine CAS Name: 2-(3-methylphenyl)-N-(1-piperidin-1-iumylidenemethyl)-3,4-dihydropyrazol-5-amine IUPAC Name: 2-(3-methylphenyl)-N-(piperidin-1-ium-1-ylidenemethyl)-3,4-dihydropyrazol-5-amine Traditional Name: [1-(m-tolyl)-2-pyrazolin-3-yl]-(piperidin-1-ium-1-ylidenemethyl)amine Formula: C16H23N4+ MolecularWeight: 271.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCC(=N2)NC=[N+]3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCC(=N2)NC=[N+]3CCCCC3

InChI

InChI=1S/C16H22N4/c1-14-6-5-7-15(12-14)20-11-8-16(18-20)17-13-19-9-3-2-4-10-19/h5-7,12-13H,2-4,8-11H2,1H3/p+1