[4-(azaniumylmethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-ethyl-phenyl-azanium

Systemtic Name: [4-(azaniumylmethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-ethyl-phenyl-azanium Openeye Name: [4-(azaniumylmethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-ethyl-phenyl-ammonium CAS Name: [4-(ammoniomethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-ethyl-phenylammonium IUPAC Name: [4-(azaniumylmethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-ethyl-phenylazanium Traditional Name: [4-(ammoniomethyl)-2,5-dimethyl-3-pyrazolin-3-ylidene]-ethyl-phenyl-ammonium Formula: C14H22N4+2 MolecularWeight: 246.35128

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C1C(=C(NN1C)C)C[NH3+])C2=CC=CC=C2

Isomeric SMILES

CC[N+](=C1C(=C(NN1C)C)C[NH3+])C2=CC=CC=C2

InChI

InChI=1S/C14H20N4/c1-4-18(12-8-6-5-7-9-12)14-13(10-15)11(2)16-17(14)3/h5-9H,4,10,15H2,1-3H3/p+2