[1-(1,2-dimethylpiperidin-1-ium-1-yl)-1-oxidanylidene-butan-2-yl] thiocyanate

Systemtic Name: [1-(1,2-dimethylpiperidin-1-ium-1-yl)-1-oxidanylidene-butan-2-yl] thiocyanate Openeye Name: 1-(1,2-dimethylpiperidin-1-ium-1-carbonyl)propyl thiocyanate CAS Name: thiocyanic acid [1-(1,2-dimethyl-1-piperidin-1-iumyl)-1-oxobutan-2-yl] ester IUPAC Name: [1-(1,2-dimethylpiperidin-1-ium-1-yl)-1-oxobutan-2-yl] thiocyanate Traditional Name: thiocyanic acid 1-(1,2-dimethylpiperidin-1-ium-1-carbonyl)propyl ester Formula: C12H21N2OS+ MolecularWeight: 241.37294

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[N+]1(CCCCC1C)C)SC#N

Isomeric SMILES

CCC(C(=O)[N+]1(CCCCC1C)C)SC#N

InChI

InChI=1S/C12H21N2OS/c1-4-11(16-9-13)12(15)14(3)8-6-5-7-10(14)2/h10-11H,4-8H2,1-3H3/q+1