1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium iodide

Systemtic Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium iodide Openeye Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium iodide CAS Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium iodide IUPAC Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium iodide Traditional Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium iodide Formula: C20H39IN2 MolecularWeight: 434.44153

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)CCCN1C=C[N+](=C1)C.[I-]

Isomeric SMILES

CCCCCCCCCCC[C@H](C)CCCN1C=C[N+](=C1)C.[I-]

InChI

InChI=1S/C20H39N2.HI/c1-4-5-6-7-8-9-10-11-12-14-20(2)15-13-16-22-18-17-21(3)19-22;/h17-20H,4-16H2,1-3H3;1H/q+1;/p-1/t20-;/m0./s1