N-(3-morpholin-4-ium-4-ylpropyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-N-(3-morpholin-4-ium-4-ylpropyl)-4H-1,4-benzothiazine-6-carboxamide Formula: C16H22N3O3S+ MolecularWeight: 336.42918

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C16H21N3O3S/c20-15-11-23-14-3-2-12(10-13(14)18-15)16(21)17-4-1-5-19-6-8-22-9-7-19/h2-3,10H,1,4-9,11H2,(H,17,21)(H,18,20)/p+1