1-hexadecyl-3,5-dimethyl-2-prop-2-enyl-pyrazol-2-ium

Systemtic Name: 1-hexadecyl-3,5-dimethyl-2-prop-2-enyl-pyrazol-2-ium Openeye Name: 1-allyl-2-hexadecyl-3,5-dimethyl-pyrazol-1-ium CAS Name: 1-hexadecyl-3,5-dimethyl-2-prop-2-enylpyrazol-2-ium IUPAC Name: 1-hexadecyl-3,5-dimethyl-2-prop-2-enylpyrazol-2-ium Traditional Name: 1-allyl-2-cetyl-3,5-dimethyl-pyrazol-1-ium Formula: C24H45N2+ MolecularWeight: 361.6275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H45N2/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-26-24(4)22-23(3)25(26)20-6-2/h6,22H,2,5,7-21H2,1,3-4H3/q+1