methyl (2S)-2-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-ium-4-yl]-3-cyclohexyl-propanoate

Systemtic Name: methyl (2S)-2-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-ium-4-yl]-3-cyclohexyl-propanoate Openeye Name: methyl (2S)-3-cyclohexyl-2-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)propanoate CAS Name: (2S)-3-cyclohexyl-2-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-cyclohexyl-2-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)propanoate Traditional Name: (2S)-3-cyclohexyl-2-(1,1-diketo-1,4-thiazinan-4-ium-4-yl)propionic acid methyl ester Formula: C14H26NO4S+ MolecularWeight: 304.42554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CCCCC1)[NH+]2CCS(=O)(=O)CC2

Isomeric SMILES

COC(=O)[C@H](CC1CCCCC1)[NH+]2CCS(=O)(=O)CC2

InChI

InChI=1S/C14H25NO4S/c1-19-14(16)13(11-12-5-3-2-4-6-12)15-7-9-20(17,18)10-8-15/h12-13H,2-11H2,1H3/p+1/t13-/m0/s1