3-cycloheptyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium

Systemtic Name: 3-cycloheptyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium Openeye Name: 3-cycloheptyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium CAS Name: 3-cycloheptyl-1,2-dimethyl-5-phenylpyrazol-1-ium IUPAC Name: 3-cycloheptyl-1,2-dimethyl-5-phenylpyrazol-1-ium Traditional Name: 3-cycloheptyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium Formula: C18H25N2+ MolecularWeight: 269.4045

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3CCCCCC3

Isomeric SMILES

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3CCCCCC3

InChI

InChI=1S/C18H25N2/c1-19-17(15-10-6-3-4-7-11-15)14-18(20(19)2)16-12-8-5-9-13-16/h5,8-9,12-15H,3-4,6-7,10-11H2,1-2H3/q+1