ethyl 3-(3,3-dimethyl-1-oxidanylidene-1,4-thiazinan-4-yl)-5-oxidanylidene-1,2,3-oxadiazol-3-ium-2-carboximidate

Systemtic Name: ethyl 3-(3,3-dimethyl-1-oxidanylidene-1,4-thiazinan-4-yl)-5-oxidanylidene-1,2,3-oxadiazol-3-ium-2-carboximidate Openeye Name: ethyl 3-(3,3-dimethyl-1-oxo-1,4-thiazinan-4-yl)-5-oxo-oxadiazol-3-ium-2-carboximidate CAS Name: 3-(3,3-dimethyl-1-oxo-1,4-thiazinan-4-yl)-5-oxo-2-oxadiazol-3-iumcarboximidic acid ethyl ester IUPAC Name: ethyl 3-(3,3-dimethyl-1-oxo-1,4-thiazinan-4-yl)-5-oxooxadiazol-3-ium-2-carboximidate Traditional Name: 5-keto-3-(1-keto-3,3-dimethyl-1,4-thiazinan-4-yl)oxadiazol-3-ium-2-carboximidic acid ethyl ester Formula: C11H19N4O4S+ MolecularWeight: 303.35796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=N)N1[N+](=CC(=O)O1)N2CCS(=O)CC2(C)C

Isomeric SMILES

CCOC(=N)N1[N+](=CC(=O)O1)N2CCS(=O)CC2(C)C

InChI

InChI=1S/C11H19N4O4S/c1-4-18-10(12)15-14(7-9(16)19-15)13-5-6-20(17)8-11(13,2)3/h7,12H,4-6,8H2,1-3H3/q+1