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

Systemtic Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium tetrafluoroborate Openeye Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium tetrafluoroborate CAS Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium tetrafluoroborate IUPAC Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium tetrafluoroborate Traditional Name: 1-methyl-3-[(4S)-4-methylpentadecyl]imidazol-1-ium tetrafluoroborate Formula: C20H39BF4N2 MolecularWeight: 394.341673

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H39N2.BF4/c1-4-5-6-7-8-9-10-11-12-14-20(2)15-13-16-22-18-17-21(3)19-22;2-1(3,4)5/h17-20H,4-16H2,1-3H3;/q+1;-1/t20-;/m0./s1