3-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 3-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 3-(1,1-dioxothiazinan-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 3-(1,1-dioxo-2-thiazinanyl)-4-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 3-(1,1-dioxothiazinan-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 3-(1,1-diketothiazinan-2-yl)-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C18H28N3O4S+ MolecularWeight: 382.49762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCOCC2)N3CCCCS3(=O)=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCOCC2)N3CCCCS3(=O)=O

InChI

InChI=1S/C18H27N3O4S/c1-15-4-5-16(14-17(15)21-7-2-3-13-26(21,23)24)18(22)19-6-8-20-9-11-25-12-10-20/h4-5,14H,2-3,6-13H2,1H3,(H,19,22)/p+1