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

Systemtic Name: 3-cyclohexyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium Openeye Name: 3-cyclohexyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium CAS Name: 3-cyclohexyl-1,2-dimethyl-5-phenylpyrazol-1-ium IUPAC Name: 3-cyclohexyl-1,2-dimethyl-5-phenylpyrazol-1-ium Traditional Name: 3-cyclohexyl-1,2-dimethyl-5-phenyl-pyrazol-1-ium Formula: C17H23N2+ MolecularWeight: 255.37792

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3CCCCC3

Isomeric SMILES

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3CCCCC3

InChI

InChI=1S/C17H23N2/c1-18-16(14-9-5-3-6-10-14)13-17(19(18)2)15-11-7-4-8-12-15/h3,5-6,9-10,13,15H,4,7-8,11-12H2,1-2H3/q+1