methyl 4-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-ium-4-yl]butanoate

Systemtic Name: methyl 4-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-ium-4-yl]butanoate Openeye Name: methyl 4-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)butanoate CAS Name: 4-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)butanoic acid methyl ester IUPAC Name: methyl 4-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)butanoate Traditional Name: 4-(1,1-diketo-1,4-thiazinan-4-ium-4-yl)butyric acid methyl ester Formula: C9H18NO4S+ MolecularWeight: 236.30852

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC[NH+]1CCS(=O)(=O)CC1

Isomeric SMILES

COC(=O)CCC[NH+]1CCS(=O)(=O)CC1

InChI

InChI=1S/C9H17NO4S/c1-14-9(11)3-2-4-10-5-7-15(12,13)8-6-10/h2-8H2,1H3/p+1