2-[(3,4-dimethoxyphenyl)methylidene]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methylidene]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-[(3,4-dimethoxyphenyl)methylene]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(3,4-dimethoxyphenyl)methylidene]-N-[2-(4-morpholin-4-iumyl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-[(3,4-dimethoxyphenyl)methylidene]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-N-(2-morpholin-4-ium-4-ylethyl)-2-veratrylidene-4H-1,4-benzothiazine-6-carboxamide Formula: C24H28N3O5S+ MolecularWeight: 470.56122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCC[NH+]4CCOCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C=C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCC[NH+]4CCOCC4)OC

InChI

InChI=1S/C24H27N3O5S/c1-30-19-5-3-16(13-20(19)31-2)14-22-24(29)26-18-15-17(4-6-21(18)33-22)23(28)25-7-8-27-9-11-32-12-10-27/h3-6,13-15H,7-12H2,1-2H3,(H,25,28)(H,26,29)/p+1