N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-pyridin-1-ium-1-yl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-pyridin-1-ium-1-yl-ethanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-pyridin-1-ium-1-yl-acetamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-2-(1-pyridin-1-iumyl)acetamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-pyridin-1-ium-1-ylacetamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-methyl-2-pyridin-1-ium-1-yl-acetamide Formula: C12H17N2O3S+ MolecularWeight: 269.33998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)C[N+]2=CC=CC=C2

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=O)C[N+]2=CC=CC=C2

InChI

InChI=1S/C12H17N2O3S/c1-13(11-5-8-18(16,17)10-11)12(15)9-14-6-3-2-4-7-14/h2-4,6-7,11H,5,8-10H2,1H3/q+1