1-decyl-3-methyl-imidazol-3-ium thiocyanate

Systemtic Name: 1-decyl-3-methyl-imidazol-3-ium thiocyanate Openeye Name: 1-decyl-3-methyl-imidazol-3-ium thiocyanate CAS Name: 1-decyl-3-methylimidazol-3-ium thiocyanate IUPAC Name: 1-decyl-3-methylimidazol-3-ium thiocyanate Traditional Name: 1-decyl-3-methyl-imidazol-3-ium thiocyanate Formula: C15H27N3S MolecularWeight: 281.45998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C=C[N+](=C1)C.C(#N)[S-]

Isomeric SMILES

CCCCCCCCCCN1C=C[N+](=C1)C.C(#N)[S-]

InChI

InChI=1S/C14H27N2.CHNS/c1-3-4-5-6-7-8-9-10-11-16-13-12-15(2)14-16;2-1-3/h12-14H,3-11H2,1-2H3;3H/q+1;/p-1