3-cyclopropyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium iodide

Systemtic Name: 3-cyclopropyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium iodide Openeye Name: 3-cyclopropyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium iodide CAS Name: 3-cyclopropyl-1,2-dimethyl-5-phenylpyrazol-1-ium iodide IUPAC Name: 3-cyclopropyl-1,2-dimethyl-5-phenylpyrazol-1-ium iodide Traditional Name: 3-cyclopropyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium iodide Formula: C14H17IN2 MolecularWeight: 340.20265

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3CC3.[I-]

Isomeric SMILES

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3CC3.[I-]

InChI

InChI=1S/C14H17N2.HI/c1-15-13(11-6-4-3-5-7-11)10-14(16(15)2)12-8-9-12;/h3-7,10,12H,8-9H2,1-2H3;1H/q+1;/p-1