2-hexadecyl-1,3-dimethyl-pyrazol-1-ium

Systemtic Name: 2-hexadecyl-1,3-dimethyl-pyrazol-1-ium Openeye Name: 2-hexadecyl-1,3-dimethyl-pyrazol-1-ium CAS Name: 2-hexadecyl-1,3-dimethylpyrazol-1-ium IUPAC Name: 2-hexadecyl-1,3-dimethylpyrazol-1-ium Traditional Name: 2-cetyl-1,3-dimethyl-pyrazol-1-ium Formula: C21H41N2+ MolecularWeight: 321.56364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C(=CC=[N+]1C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C(=CC=[N+]1C)C

InChI

InChI=1S/C21H41N2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23-21(2)18-20-22(23)3/h18,20H,4-17,19H2,1-3H3/q+1