ethyl 4-(1,3-dithiol-2-ylidene)piperazin-4-ium-1-carboxylate perchlorate

Systemtic Name: ethyl 4-(1,3-dithiol-2-ylidene)piperazin-4-ium-1-carboxylate perchlorate Openeye Name: ethyl 4-(1,3-dithiol-2-ylidene)piperazin-4-ium-1-carboxylate perchlorate CAS Name: 4-(1,3-dithiol-2-ylidene)-1-piperazin-4-iumcarboxylic acid ethyl ester perchlorate IUPAC Name: ethyl 4-(1,3-dithiol-2-ylidene)piperazin-4-ium-1-carboxylate perchlorate Traditional Name: 4-(1,3-dithiol-2-ylidene)piperazin-4-ium-1-carboxylic acid ethyl ester perchlorate Formula: C10H15ClN2O6S2 MolecularWeight: 358.8189

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[N+](=C2SC=CS2)CC1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC(=O)N1CC[N+](=C2SC=CS2)CC1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C10H15N2O2S2.ClHO4/c1-2-14-9(13)11-3-5-12(6-4-11)10-15-7-8-16-10;2-1(3,4)5/h7-8H,2-6H2,1H3;(H,2,3,4,5)/q+1;/p-1