2-(3-methyl-5-phenyl-pyrazolidin-4-yl)-1H-benzimidazol-1-ium chloride

Systemtic Name: 2-(3-methyl-5-phenyl-pyrazolidin-4-yl)-1H-benzimidazol-1-ium chloride Openeye Name: 2-(3-methyl-5-phenyl-pyrazolidin-4-yl)-1H-benzimidazol-1-ium chloride CAS Name: 2-(3-methyl-5-phenyl-4-pyrazolidinyl)-1H-benzimidazol-1-ium chloride IUPAC Name: 2-(3-methyl-5-phenylpyrazolidin-4-yl)-1H-benzimidazol-1-ium chloride Traditional Name: 2-(3-methyl-5-phenyl-pyrazolidin-4-yl)-1H-benzimidazol-1-ium chloride Formula: C17H19ClN4 MolecularWeight: 314.81256

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(NN1)C2=CC=CC=C2)C3=NC4=CC=CC=C4[NH2+]3.[Cl-]

Isomeric SMILES

CC1C(C(NN1)C2=CC=CC=C2)C3=NC4=CC=CC=C4[NH2+]3.[Cl-]

InChI

InChI=1S/C17H18N4.ClH/c1-11-15(16(21-20-11)12-7-3-2-4-8-12)17-18-13-9-5-6-10-14(13)19-17;/h2-11,15-16,20-21H,1H3,(H,18,19);1H