ethyl 1-(1,3-dithiol-2-ylidene)-6-methyl-piperidin-1-ium-3-carboxylate perchlorate

Systemtic Name: ethyl 1-(1,3-dithiol-2-ylidene)-6-methyl-piperidin-1-ium-3-carboxylate perchlorate Openeye Name: ethyl 1-(1,3-dithiol-2-ylidene)-6-methyl-piperidin-1-ium-3-carboxylate perchlorate CAS Name: 1-(1,3-dithiol-2-ylidene)-6-methyl-3-piperidin-1-iumcarboxylic acid ethyl ester perchlorate IUPAC Name: ethyl 1-(1,3-dithiol-2-ylidene)-6-methylpiperidin-1-ium-3-carboxylate perchlorate Traditional Name: 1-(1,3-dithiol-2-ylidene)-6-methyl-piperidin-1-ium-3-carboxylic acid ethyl ester perchlorate Formula: C12H18ClNO6S2 MolecularWeight: 371.85742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC([N+](=C2SC=CS2)C1)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC(=O)C1CCC([N+](=C2SC=CS2)C1)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H18NO2S2.ClHO4/c1-3-15-11(14)10-5-4-9(2)13(8-10)12-16-6-7-17-12;2-1(3,4)5/h6-7,9-10H,3-5,8H2,1-2H3;(H,2,3,4,5)/q+1;/p-1