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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CC(=O)NC2CCS(=O)(=O)C2

Isomeric SMILES

CC1=CC=CC=[N+]1CC(=O)N[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C12H16N2O3S/c1-10-4-2-3-6-14(10)8-12(15)13-11-5-7-18(16,17)9-11/h2-4,6,11H,5,7-9H2,1H3/p+1/t11-/m0/s1