2-(4-chloranyl-3-methyl-phenyl)-4-(4,5-dihydro-1H-imidazol-2-yl)-1H-pyrazol-2-ium-3-amine

Systemtic Name: 2-(4-chloranyl-3-methyl-phenyl)-4-(4,5-dihydro-1H-imidazol-2-yl)-1H-pyrazol-2-ium-3-amine Openeye Name: 2-(4-chloro-3-methyl-phenyl)-4-(4,5-dihydro-1H-imidazol-2-yl)-1H-pyrazol-2-ium-3-amine CAS Name: 2-(4-chloro-3-methylphenyl)-4-(4,5-dihydro-1H-imidazol-2-yl)-1H-pyrazol-2-ium-3-amine IUPAC Name: 2-(4-chloro-3-methylphenyl)-4-(4,5-dihydro-1H-imidazol-2-yl)-1H-pyrazol-2-ium-3-amine Traditional Name: [2-(4-chloro-3-methyl-phenyl)-4-(2-imidazolin-2-yl)-1H-pyrazol-2-ium-3-yl]amine Formula: C13H15ClN5+ MolecularWeight: 276.7447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+]2=C(C(=CN2)C3=NCCN3)N)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+]2=C(C(=CN2)C3=NCCN3)N)Cl

InChI

InChI=1S/C13H14ClN5/c1-8-6-9(2-3-11(8)14)19-12(15)10(7-18-19)13-16-4-5-17-13/h2-3,6-7H,4-5H2,1H3,(H3,15,16,17,18)/p+1