2-(2-morpholin-4-ium-4-ylethanoyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethanoyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-(2-morpholin-4-ium-4-ylacetyl)-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-(2-morpholin-4-ium-4-ylacetyl)-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-(2-morpholin-4-ium-4-ylacetyl)-1,2-benzothiazol-3-one Formula: C13H15N2O5S+ MolecularWeight: 311.3336

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)N2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C1COCC[NH+]1CC(=O)N2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C13H14N2O5S/c16-12(9-14-5-7-20-8-6-14)15-13(17)10-3-1-2-4-11(10)21(15,18)19/h1-4H,5-9H2/p+1